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Theory - Chemistry Research Interest Group

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Colloquia are held on term time Wednesdays at 2.30pm in the Unilever Lecture Theatre, Dept of Chemistry, unless otherwise stated.

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If you have a question about this list, please contact: Lisa Masters. If you have a question about a specific talk, click on that talk to find its organiser.

5 upcoming talks and 425 talks in the archive.

Collective Dynamics in Non-Equilibrium Fluids

UserProfessor Robert Jack, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 06 March 2024, 14:30-15:30

Liquid Water at Coupled Cluster Accuracy

UserProfessor Dominik Marx, Ruhr-University Bochum.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 21 February 2024, 14:30-15:30

Foundation Models for Materials Chemistry

UserProfessor Gábor Csanyi, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 14 February 2024, 14:30-15:30

London Dispersion in Density-Functional Theory and the Exchange-Hole Dipole Moment Model

A joint Lennard-Jones Centre talk

UserProfessor Erin Johnson, Dalhousie University.

HousePfizer Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 07 February 2024, 15:30-16:30

Artificial chemistries: From designing matter to mimicking life



UserDr Zorana Zeravcic, ESPCI Paris PSL Research University.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 17 January 2024, 14:30-15:30

Magnetism in 2D materials

UserProfessor Biplab Sanyal, Uppsala University.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 29 November 2023, 14:30-15:30

Making Sense of Electrical Noise by Simulating Electrolyte Solutions

UserProfessor Benjamin Rotenberg, Sorbonne University.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 22 November 2023, 14:30-15:30

Uncovering Molecular Transport Mechanisms by Counting with Colloids

UserProfessor Alice Thorneywork, University of Oxford.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 15 November 2023, 14:30-15:30

Solvation Across Length Scales: A Classical Density Functional Theory

1st Year PhD Report

UserAnna Bui, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 08 November 2023, 15:00-15:30

Path Integral Approaches to Spin-Phonon Coupled Systems

1st Year PhD Report

UserIlija Srpak, University of Cambridge and Max Planck Institute.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 08 November 2023, 14:30-15:00

Fifty Years Simulating Water and Electrolyte Solutions : Where Are We?

UserProfessor Carlos Vega de las Heras, University Complutense of Madrid.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 01 November 2023, 14:30-15:30

Relativistic QED developments for atomic and molecular bound state computations

UserDr Edit Mátyus, ELTE Faculty of Science, Budapest.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 18 October 2023, 14:30-15:30

Learning from molecular dynamics trajectory ensembles

UserProfessor Peter Bolhuis, University of Amsterdam.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 11 October 2023, 14:30-15:30

Tackling Topology with TopoStats

UserDr Alice Pyne, University of Sheffield.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 17 May 2023, 14:30-15:30

Quantum Theory of Imperfect Crystals

UserProfessor Aron Walsh, Imperial College London.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 10 May 2023, 14:30-15:30

Non-unitary Trotter circuits for imaginary time evolution

First Year PhD Report

UserChiara Leadbeater, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 03 May 2023, 14:30-15:00

Quantum theory of electronic friction

UserProfessor Rocco Martinazzo, University of Milan.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 26 April 2023, 14:30-15:30

Activity induced phase separation and ordering in various model soft matter systems

Theoretical Chemistry/Lennard-Jones Centre Seminar https://zoom.us/j/92447982065?pwd=RkhaYkM5VTZPZ3pYSHptUXlRSkppQT09

UserProfessor Prabal Maiti, Indian Institute of Science, Bangalore.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry & Zoom.

ClockWednesday 29 March 2023, 14:30-15:30

Crumbling Crystals

First Year PhD Report

UserNiamh O'Neill, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 15 March 2023, 15:00-15:30

Exploring and implementing molecular counterfactuals for chemical toxicology prediction

First Year PhD Report

UserKatie Beckwith, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 15 March 2023, 14:30-15:00

Spin dynamics in radical pairs

UserProfessor David Manolopoulos, University of Oxford.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 01 March 2023, 14:30-15:30

Energy landscapes of Zeolitic Imidazolate Frameworks (ZIFs)

First Year PhD Report

UserArun Kumar Rajasekaran, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 08 February 2023, 15:00-15:30

Found In Translation: Using Language Models To Predict C–H Borylation Regioselectivity

First Year PhD Report

UserRuslan Kotlyarov, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 08 February 2023, 14:30-15:00

Multiscale Simulation of DNA

Extra Theoretical Chemistry Seminar

UserDr Modesto Orozco, IRB Barcelona.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockFriday 03 February 2023, 11:00-12:00

Applying Matsubara Dynamics to Study Rates in Thermally Dissipative Systems

First Year PhD Report

UserWilliam Moore, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 01 February 2023, 15:00-15:30

Recent developments with the Transcorrelated method

UserProfessor Ali Alavi, University of Cambridge.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockWednesday 25 January 2023, 14:30-15:30

Go EAST, young scientist - First principles view on chemical compound space

UserProfessor Anatole von Lilienfeld, University of Toronto.

HouseUnilever Lecture Theatre, Yusuf Hamied Department of Chemistry.

ClockTuesday 29 November 2022, 14:30-15:30

The Chemical Physics of Correlated Materials

https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserProfessor Garnet Chan, Caltech.

Housevia zoom .

ClockWednesday 23 November 2022, 17:00-18:00

Development of a sequence-dependent coarse-grained model for probing protein aggregation

1st Year PhD Report https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserKieran Russell, University of Cambridge.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 16 November 2022, 15:00-15:30

Designing multiphase biomolecular condensates

First Year PhD Report https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserPin Yu Chew, University of Cambridge.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 16 November 2022, 14:30-15:00

The role played by interactions in the assembly of active colloids: Discovering dynamic laws from observations.

https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserDr Chantal Valeriani, Universidad Complutense de Madrid.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 09 November 2022, 14:30-15:30

Programmable Folding of Droplet Colloidomers

https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserProfessor Jasna Brujic, NYU.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 02 November 2022, 14:30-15:30

The many phases of Filinov filtration: mixed-limit semiclassical dynamics

https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserDr Nandini Ananth, Cornell University.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 26 October 2022, 14:30-15:30

UNICORN (UNIted COarse gRaiNed) Force Field

https://zoom.us/j/97189750171?pwd=RlppL21lSFJnVkwwSG4xeTE3a0NWQT09 Meeting ID: 971 8975 0171 Passcode: 320880

UserDr Adam Sieradzan, University of Gdańsk.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 19 October 2022, 14:30-15:30

Bringing Quantum Mechanics for Electrons and Nuclei to Larger Scales

https://zoom.us/j/97412460697?pwd=SkZzdjZGNFUyakg2RkpwMnRCWkZ3dz09 Meeting ID: 974 1246 0697 Passcode: 804768

UserDr Mariana Rossi, Max Planck Institute .

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 25 May 2022, 14:30-15:30

Designing an Advanced Cancer Therapeutic Protein (GABPA Binding Inhibitor) Using an Artificial Intelligence-based DNA Binding Protein Design system.

https://zoom.us/j/96081156517?pwd=dmVGcVdDMXYvcVljdjVUQVIrd3F3QT09 Meeting ID: 960 8115 6517 Passcode: 135523

UserHaseem Deen Mohamed Sarif Mohamed Iqbal, University of Cambridge .

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 18 May 2022, 15:00-15:30

A computational model for protein phase separation: hnRNPA1 as a case study

https://zoom.us/j/96081156517?pwd=dmVGcVdDMXYvcVljdjVUQVIrd3F3QT09 Meeting ID: 960 8115 6517 Passcode: 135523

UserMaria Julia Maristany, University of Cambridge.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 18 May 2022, 14:30-15:00

Building bridges over mountain passes with variational path sampling

https://zoom.us/j/92686443414?pwd=OXVvY3lubnYxdU04enVZNFEzcjNmdz09 Meeting ID: 926 8644 3414 Passcode: 815149

UserDr David Limmer, UC Berkeley.

HouseZoom and will be lived streamed in the Dept of Chemistry, Wolfson Lecture Theatre .

ClockWednesday 11 May 2022, 16:30-17:30

Machine Learning for Molecular Simulation - from Quantum Chemistry to Protein Dynamics

Join Zoom Meeting https://zoom.us/j/91726565686?pwd=cmpNYmswRlRRamgycGhiT29jSE44UT09 Meeting ID: 917 2656 5686 Passcode: 592709

UserProfessor Frank Noé, Free University Berlin.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 04 May 2022, 14:30-15:30

Angstrom-scale capillaries: Ion selectivity beyond steric effects

https://zoom.us/j/93042336923?pwd=V0dZc1hjcEhESXdGcGhDbGxYRTZQZz09 Meeting ID: 930 4233 6923 Passcode: 942671

UserProfessor Radha Boya, University of Manchester.

HouseDept of Chemistry, Wolfson Lecture Theatre and Zoom.

ClockWednesday 27 April 2022, 14:30-15:30

The liquid genome: Multiscale modelling of DNA packaging inside cells

https://zoom.us/j/99261863179?pwd=cExLK0QrdTF5R1c3bDNiWWwrbUtwdz09 Meeting ID: 992 6186 3179 Passcode: 180099

UserDr Rosana Collepardo-Guevara, University of Cambridge.

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockThursday 17 March 2022, 11:15-12:15

One becomes two: assemblies that split cells across evolution

https://zoom.us/j/92220720173?pwd=WWVpVzVRY3dGRlhCRnFJZE81enRlUT09 Meeting ID: 922 2072 0173 Passcode: 070083

UserDr Anđela Šarić, IST Austria .

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 09 March 2022, 14:30-15:30

Simple Models for Liquid-Liquid Phase Separation in Biological Cells

https://zoom.us/j/92110994248?pwd=VHVlRE15bUJRZ0pOcDdwdlQ3V0cwUT09 Meeting ID: 921 1099 4248 Passcode: 360337

UserProfessor Halim Kusumaatmaja, Durham University.

HouseDept of Chemistry, Wolfson Lecture Theatre and Zoom.

ClockWednesday 02 March 2022, 14:30-15:30

Development of a transferable coarse-grained model for biomolecular phase-separation with near-quantitative accuracy.

1st Year PhD Report https://zoom.us/j/97218330219?pwd=cm5obGVnMVJ1RmZML3Rtc1RNRlc1dz09 Meeting ID: 972 1833 0219 Passcode: 540145

UserAnne Aguirre, University of Cambridge.

HouseWolfson Lecture Theatre, Dept of Chemistry and Zoom.

ClockWednesday 23 February 2022, 15:00-15:30

General embedded cluster protocol for accurate modelling of oxygen vacancies in metal-oxides

First Year PhD Report https://zoom.us/j/99862441719?pwd=OHc4d0hpczU4SVpEK0ppUHliUVRSUT09 Meeting ID: 998 6244 1719 Passcode: 373295https://zoom.us/j/97218330219?pwd=cm5obGVnMVJ1RmZML3Rtc1RNRlc1dz09 Meeting ID: 972 1833 0219 Passcode: 540145

UserBenjamin Shi (University of Cambridge).

HouseWolfson Lecture Theatre, Dept. of Chemistry & Zoom.

ClockWednesday 23 February 2022, 14:30-15:00

Quantum simulations of materials for sustainable energy generation and use

https://zoom.us/j/99306849914?pwd=dDg3YWkvTjZKaTc3RHZQbWxsb1QvUT09 Meeting ID: 993 0684 9914 Passcode: 982405

UserProfessor Giulia Galli, University of Chicago.

HouseDept of Chemistry, Wolfson Lecture Theatre and Zoom.

ClockWednesday 16 February 2022, 15:00-16:00

Hot electrons in chemical reactions at metal surfaces: From molecular beam scattering to plasmonic chemistry

https://zoom.us/j/98783704195?pwd=L0hDVDJYeDdRYkR5TGFyeEV3RE1vZz09 Meeting ID: 987 8370 4195 Passcode: 689645

UserDr Reinhard J. Maurer, University of Warwick.

HouseWolfson Lecture Theatre, Dept. of Chemistry & Zoom.

ClockWednesday 09 February 2022, 14:30-15:30

Energy Landscape of Hybrid Restraint Functions Based on NMR Data

1st Year PhD Report. Join Zoom meeting https://zoom.us/j/99862441719?pwd=OHc4d0hpczU4SVpEK0ppUHliUVRSUT09 Meeting ID: 998 6244 1719 Passcode: 373295

UserYifei Wang, University of Cambridge.

HouseZoom.

ClockWednesday 02 February 2022, 15:00-15:30

Variational calculations of monoatomic endofullerenes

First Year PhD Report. Join Zoom meeting https://zoom.us/j/99862441719?pwd=OHc4d0hpczU4SVpEK0ppUHliUVRSUT09 Meeting ID: 998 6244 1719 Passcode: 373295

UserKripa Panchagnula, University of Cambridge.

Housevia zoom .

ClockWednesday 02 February 2022, 14:30-15:00

Realistic simulations of IR spectra using path-integrals: quasicentroid molecular dynamics

First Year PhD Report https://zoom.us/j/97542686010?pwd=OHY3Mzd6NUptaHpzTDJkOUY2QTFzZz09 Meeting ID: 975 4268 6010 Passcode: 417918

UserChristopher Haggard, University of Cambridge.

Housevia zoom .

ClockWednesday 26 January 2022, 15:00-15:30

The origin of enantioselectivity in photochemical reactions with diarylprolinol silyl ether catalysts

First Year PhD Report https://zoom.us/j/97542686010?pwd=OHY3Mzd6NUptaHpzTDJkOUY2QTFzZz09 Meeting ID: 975 4268 6010 Passcode: 417918

UserChing Ching Lam, University of Cambridge.

Housevia zoom .

ClockWednesday 26 January 2022, 14:30-15:00

Genome Organization through Phase Separation: Random yet Precise

https://zoom.us/j/99705960225?pwd=VnB5WW9YWHNrUXRFZmFQOU1wQW5lUT09 Meeting ID: 997 0596 0225 Passcode: 198245

UserDr Bin Zhang, Massachusetts Institute of Technology.

Housevia zoom .

ClockWednesday 19 January 2022, 14:30-15:30

Exploring the interface between carbon based materials and electrolytes: Insights from simulations

https://zoom.us/j/98671840072?pwd=TXRNaHVIS0VlYWEzTm5YVUVWbThCQT09 Meeting ID: 986 7184 0072 Passcode: 366353

UserDr Céline Merlet, Université Toulouse 3 Paul Sabatier .

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 01 December 2021, 14:30-15:30

Scalable multi-reference chemistry using quantum Monte Carlo

https://zoom.us/j/93027947380?pwd=TTIrV3hPaFV4SlRyZm85UHF0d0RxUT09 Meeting ID: 930 2794 7380 Passcode: 697350

UserDr Nick Blunt, Riverlane.

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 24 November 2021, 14:30-15:30

Development Of A Multiscale Chromatin Coarse-Grained Model

First Year PhD Report

UserCharles Phillips, University of Cambridge.

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 17 November 2021, 15:00-15:30

Base flipping in DNA using potential energy landscapes

First Year PhD Report

UserNicy, University of Cambridge.

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 17 November 2021, 14:30-15:00

On Loss Function Landscapes of Neural Networks

First Year PhD Report. Zoom details Meeting ID: 915 2238 0125 Passcode: 224474

UserMax Niroomand, University of Cambridge.

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 10 November 2021, 15:00-15:30

Non-Equilibrium Phase Transitions of Two Species Driven Diffusive Lattice Gas

First Year PhD Report. Zoom details: Meeting ID: 915 2238 0125 Passcode: 224474

UserHonghao Yu, University of Cambridge.

HouseZoom and Dept of Chemistry, Wolfson Lecture Theatre.

ClockWednesday 10 November 2021, 14:30-15:00

Machine Learning for Intermolecular Interactions

UserProfessor David Sherrill, Georgia Tech.

HouseZoom: Meeting ID: 936 2232 6567 Passcode: 659838.

ClockWednesday 12 May 2021, 15:00-16:00

Nanoconfined Water and it's Anomalies

UserProfessor Biman Bagchi, Indian Institute of Science - Bengaluru.

HouseZoom: Meeting ID: 993 0985 5457 Passcode: 520993.

ClockWednesday 05 May 2021, 10:00-11:00

The Phase Behaviour of Supercooled Water: Recent Computational Results.

UserProfessor Pablo Debenedetti, Princeton University.

HouseZoom: Meeting ID: 960 7975 3507 Passcode: 674325.

ClockWednesday 28 April 2021, 14:30-15:30

Quantum Machine Learning for Accurate and Low-Cost Computational Chemistry

UserProfessor Thomas F. Miller III, Caltech.

HouseZoom: Meeting ID: 974 4858 8660 Passcode: 016125.

ClockWednesday 17 March 2021, 16:00-17:00

Let there be light: exploiting machine learning to elucidate optical spectroscopy in the condensed phase

UserProfessor Thomas Markland, Stanford University.

HouseZoom - link to be announced.

ClockWednesday 10 March 2021, 17:00-18:00

Structure and dynamics of ionic liquids confined between metallic surfaces

UserProfessor Marialore Sulpizi, Johannes Gutenberg University.

HouseZoom: Meeting ID: 956 7058 2700 Passcode: 141090.

ClockWednesday 03 March 2021, 14:30-15:30

Reaction mechanism discovery using random walks in chemical space

UserProfessor Scott Habershon, University of Warwick.

HouseZoom - Meeting ID: 946 2143 4053 Passcode: 203059.

ClockWednesday 24 February 2021, 14:30-15:30

Generalization of Quasicentroid Molecular Dynamics to complex systems

First Year PhD Report

UserVijay Ganesh Sadhasivam, University of Cambridge.

HouseZoom: Meeting ID: 971 8360 9971 Passcode: 458262.

ClockWednesday 17 February 2021, 15:00-15:30

A systematic conformational searching method

First Year PhD Report

UserMengman Wei, University of Cambridge.

HouseZoom: Meeting ID: 971 8360 9971 Passcode: 458262.

ClockWednesday 17 February 2021, 14:30-15:00

Computational modelling of genome organisation - Understanding the compaction of DNA within cells

First Year PhD Report

UserEsmae Woods, University of Cambridge .

HouseZoom Meeting ID: 983 5633 9540 Passcode: 268115.

ClockWednesday 10 February 2021, 15:00-15:30

Quantifying the applicability domain between two datasets using Tanimoto similarity

First Year PhD Report

UserMarcus Wang, University of Cambridge.

HouseZoom Meeting ID: 983 5633 9540 Passcode: 268115.

ClockWednesday 10 February 2021, 14:30-15:00

Predicting material properties with the help of machine learning

UserDr Bingqing Cheng, University of Cambridge.

HouseZoom: Meeting ID: 976 0491 4122 Passcode: 108408.

ClockWednesday 27 January 2021, 14:30-15:30

Understanding transition metal heterogeneous catalysis

UserProfessor Jens Kehlet Nørskov, Technical University of Denmark.

HouseZoom: Meeting ID: 983 4340 7484 Passcode: 162366.

ClockWednesday 20 January 2021, 14:00-15:00

Ice nucleation without supercooling: on the search for the most potent ice nucleants.

UserProfessor Valeria Molinero, University of Utah.

HouseZoom - Meeting ID: 916 8928 5361 Passcode: 848429.

ClockWednesday 02 December 2020, 16:00-17:00

The hydrophobic effect characterises the thermodynamic signature of amyloid fibril growth

UserDr Sanne Abeln, Vrije University Amsterdam.

HouseZoom - link to be announced.

ClockWednesday 25 November 2020, 14:30-15:30

Evolved minimal frustration - How multiple functions are encoded in biomolecules

UserDr Konstantin Röder, University of Cambridge.

HouseZoom Meeting ID: 928 9045 3974 Passcode: 313781.

ClockWednesday 18 November 2020, 14:30-15:30

First-principles simulation of electronic processes due to ionic projectiles traversing matter

UserProfessor Emilio Artacho, University of Cambridge.

HouseZoom Meeting ID: 981 1605 6934 Passcode: 258737.

ClockWednesday 11 November 2020, 14:30-15:30

Wavefunction based correlation methods for molecular condensed phase systems

UserProfessor Jürg Hutter, University of Zurich.

HouseZoom - Meeting ID: 933 6001 1482 Passcode: 782662.

ClockWednesday 04 November 2020, 14:30-15:30

In silico identification of reactivity driven MIEs

First Year PhD Report

UserCharles Gong, University of Cambridge.

HouseZoom - Meeting ID: 924 3189 5042 Passcode: 306870.

ClockWednesday 28 October 2020, 15:00-15:30

Machine Learning for Critical Care: Using Neural Networks to Predict Patient Mortality

First Year PhD Report

UserConor Cafolla, University of Cambridge.

HouseZoom - Meeting ID: 924 3189 5042 Passcode: 306870.

ClockWednesday 28 October 2020, 14:30-15:00

Cloud-mounted Molecular Experiments during COVID times

UserDr David Glowacki, University of Bristol.

HouseZoom Meeting ID: 986 1567 0048 Passcode: 266539.

ClockWednesday 21 October 2020, 14:30-15:30

Theoretical Predictions of Superconducting and Superhard Materials

UserProfessor Eva Zurek, University at Buffalo.

HouseZoom Meeting ID: 994 9249 3911 Passcode: 603941 .

ClockWednesday 14 October 2020, 15:00-16:00

The Sum of its Parts: MBE-FCI Theory

UserDr Janus Juul Eriksen, University of Bristol.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 26 February 2020, 14:15-15:15

Quantum topological effects in the transport properties of ionic conductors

UserProfessor Stefano Baroni, SISSA — Scuola Internazionale Superiore di Sudi Avanzati, Trieste.

HouseDepartment of Chemistry, Cambridge, Pfizer Lecture Theatre.

ClockWednesday 12 February 2020, 14:15-15:15

Deep Learning for Molecular Physics

UserProfessor Frank Noe, Freie Universitaet Berlin.

HouseDepartment of Chemistry, Cambridge, Wolfson Lecture Theatre.

ClockFriday 31 January 2020, 14:15-15:15

Synthetic maps for navigating high-dimensional data spaces

UserProfessor Alessandro Laio, SISSA Trieste.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 04 December 2019, 14:15-15:15

System-bath quantum dynamics in chemical physics

UserProfessor Peter Saalfrank, University of Potsdam.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 20 November 2019, 14:15-15:15

Pathway to Nonlinear Spectroscopy of Discrete Dipoles

First Year PhD Report

UserHaydn Lloyd, University of Cambrisge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 13 November 2019, 14:40-15:00

Multireference Stochastic Coupled Cluster

First Year PhD Report

UserMaria-Andreea Filip, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 13 November 2019, 14:15-14:35

Hierarchical equations of motion

First Year PhD Report

UserAdam Prada, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 06 November 2019, 14:40-15:00

Rapid Route-Finding for Bifurcating Organic Reactions

First Year PhD Report

UserSanha Lee, University of Cambride.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 06 November 2019, 14:15-14:35

DP4-AI Automated NMR Data Analysis: Straight from Spectrometer to Structure

First Year PhD Report

UserAlexander Howarth, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 30 October 2019, 14:40-15:00

Composite Gaussian processes for probabilistic PES prediction

First Year PhD Report

UserFabio Albertani, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 30 October 2019, 14:15-14:35

Understanding the Dynamics of Unentangled Associating Polymers by Means of Molecular Simulations

UserProfessor Jorge Ramírez García, Universidad Politecnica De Madrid.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 05 June 2019, 14:15-15:15

Using the Energy Landscape to Elucidate Protein-Ligand Interactions

First Year PhD Report

UserAlasdair Keith, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 29 May 2019, 14:15-14:35

New Directions for Random Search

UserProfessor Chris Pickard, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 22 May 2019, 14:15-15:15

Highly Polar Supramolecular Species with Enhanced IR Activity

UserProfessor Fedor Naumkin, University of Ontario.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 15 May 2019, 14:15-15:15

The Vibrational Dynamics of the Hydrated Proton

UserProfessor Joel Bowman, Emory University.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 06 March 2019, 14:15-15:15

Use of different types of information to better understand compounds’ Mechanism of Action.

First Year PhD Report

UserMaria-Anna Trapotsi, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 27 February 2019, 14:15-14:35

Force Fields and Potential Energy Surfaces

UserProfessor Gábor Csányi, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 23 January 2019, 14:15-15:15

Physical and Chemical Aspects of Surface Chirality

UserProfessor Stephen Jenkins, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 16 January 2019, 14:15-15:15

Using the Force with Quantum Monte Carlo

UserProfessor Claudia Filippi, University of Twente.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 28 November 2018, 14:15-15:15

Computational Design and Discovery of Novel Materials

UserProfessor Nicola Marzari, EPFL.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 21 November 2018, 14:15-15:15

Visualizing Electrostatics of a Single Biomolecule in the Fluid Phase

UserProfessor Madhavi Krishnan, University of Oxford.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 14 November 2018, 14:15-15:15

Programming Hierarchical Self-Assembly for Colloidal Open Crystals

UserDr Dwaipayan Chakrabarti, University of Birmingham.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 31 October 2018, 14:15-15:15

Pathways of Amyloid Aggregation

UserDr Birgit Strodel, Forschungszentrum Jülich.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 24 October 2018, 14:15-15:15

Energy Landscapes of Amyloid Oligomers

First Year PhD Report

UserLuke Dicks, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 17 October 2018, 14:40-15:00

Matsubara Fluctuations and their Effects on Infrared Spectra

First Year PhD Report

UserRaz Benson, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 17 October 2018, 14:15-14:35

Constant-Uncertainty Molecular Dynamics - A New Method for Approximating Quantum Dynamics?

First Year PhD Report

UserSundeep Popat, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 10 October 2018, 14:40-15:00

Selected CI and Jastrow-free QMC methods for Chemistry

UserDr Pierre-Francois Loos, Université de Toulouse.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 16 May 2018, 14:15-15:15

Using Sequence Data to Probe the Determinants of Higher Order Structure in Fibrallar Collagens

First Year PhD Report

UserAnna Puszkarska, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 09 May 2018, 14:40-15:00

How can we understand Quantum Rate Theory with the help of Matsubara Dynamics?

First Year PhD Report

UserEszter Pós, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 09 May 2018, 14:15-14:35

What are Extrasolar planets made of? Molecular line lists for hot atmospheres.

UserProfessor Jonathan Tennyson, University College London.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 02 May 2018, 14:15-15:15

Symmetry, Degeneracy, and Strong Correlation

UserProfessor Gustavo E. Scuseria, Rice University.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 25 April 2018, 14:15-15:15

Source-and-Sink Models for Molecular Conduction

UserProfessor Patrick Fowler, Unitversity of Sheffield .

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 14 March 2018, 14:15-15:15

Modelling diffusion-osmosis

First Year PhD Report

UserSimon Ramirez Hinestrosa, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 07 March 2018, 14:55-15:15

Depolarising Polar Surface Simulations

First Year PhD Report

UserThomas Sayer, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 07 March 2018, 14:35-14:55

Efficient Storage Mechanisms for Building Better Supercapacitors

UserProfessor Mathieu Salanne, Sorbonne Université.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 21 February 2018, 14:15-15:15

Second Harmonic Scattering: Atomistic Simulation and Machine Learning

UserDr David M. Wilkins, Laboratory of Computational Science and Modelling, EPFL.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 14 February 2018, 14:15-15:15

The Thermodynamic Uncertainty Relation

UserDr Karel Proesmans, University of Hasselt.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 24 January 2018, 14:15-15:15

Big Molecules and Small Particles

UserProfessor Lennart Lindfors, University of Gothenburg.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 17 January 2018, 14:15-15:15

Covalent and Non-Covalent Interactions in Molecular Systems

UserProfessor Alexandre Tkatchenko, University of Luxembourg.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 06 December 2017, 14:15-15:15

Slimming Down Through Frustration

UserDr Martin Lenz, Université Paris-Sud.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 22 November 2017, 14:15-15:15

The Challenges to Theory of Predicting the Crystallisation of Organic Molecules

UserProfessor Sally Price, University College London.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 15 November 2017, 14:15-15:15

Quantum Machine Learning

UserProfessor Anatole von Lilienfeld, University of Basel.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 08 November 2017, 14:15-15:15

Liquid State Theory Meets Deep Learning and Molecular Informatics

UserDr Alpha Lee, University of Cambridge, Department of Physics.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 25 October 2017, 14:15-15:15

Predicting and Designing the Self-Assembly of Colloidal Particles: A Computer Game

Formal Materials - Theory Seminar

UserProfessor Marjolein Dijkstra, Utrecht University.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockFriday 20 October 2017, 13:00-14:00

Computing and Understanding the Ro-Vibrational Spectrum of CH5+

UserProfessor Tucker Carrington, Queen's University.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 18 October 2017, 14:15-15:15

Alternative Approaches to Chemical Risk Assessment: Assays, Databases, Models

Dr Richard Judson is a research chemist at the US EPA's National Center for Computational Toxicology. His research involves the development of databases and computer models to predict toxicological effects across a wide variety of chemicals.

UserDr Richard Judson, EPA National Centre for Computational Toxicology.

HouseDepartment of Chemistry, Cambridge, Todd Hamied Room.

ClockMonday 26 June 2017, 14:00-15:00

Theory RIG Informal Symposium

UserFredrik Svensson, Laura Mitchell & Brian Ng.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockMonday 12 June 2017, 16:00-19:00

The Entropy Production Paradox: The Mysterious World Between Diffusion and Waves.

UserProfessor Christopher Essex, University of Western Ontario.

HouseDepartment of Chemistry, Cambridge, Todd Hamied Room.

ClockMonday 01 May 2017, 10:00-11:00

First-principles simulation of electrochemical reactions at solid-liquid interface

UserDr Minoru Otani, National Institute of Advanced Inductrial Science and Technology (AIST).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 08 February 2017, 14:15-15:15

Informal TMI RIG Seminar

UserPatrick Lewis, Chongli Qin & Dr Nitin Sharma.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 08 June 2016, 16:00-17:30

Active Pressure

UserProfessor Mike Cates (DAMTP).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 09 March 2016, 14:15-15:15

Active Pressure

UserProfessor Mike Cates (DAMTP).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockFriday 04 March 2016, 14:15-15:15

Including Quantum effects into Molecular Simulation.

UserDr Jens Poulsen, University of Gothenburg.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 17 February 2016, 14:15-15:15

Disordered Hyperuniform Many-Particle Systems: New States of Amorphous Matter

UserSalvatore Torquato Dept. of Chemistry, Dept. of Physics, Materials Institute and Applied & Computational Mathematics, Princeton University.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockMonday 07 December 2015, 16:00-17:00

Upside Down and Inside Out: The Biomechanics of Cell Sheet Folding

UserRay Goldstein, DAMTP, Cambridge University.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 11 November 2015, 14:15-15:15

Modeling embryonic patterning with human embryonic stem cell colonies

UserEric Siggia, Rockefeller University.

HouseTodd Hamied Room, Dept. of Chemistry.

ClockWednesday 03 June 2015, 14:15-15:15

DE NOVO PROTEINS: MYTH OR MYSTERY?

UserErich Bornberg-Bauer, The Westfalian Wilhelms University of Münster.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 20 May 2015, 14:15-15:15

Towards Artificial Living Materials

UserMichael Brenner, Harvard University.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 13 May 2015, 14:15-15:15

Multiscale modelling of polymers at the soft-bio interface

UserPaola Carbone, University of Manchester.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 06 May 2015, 14:15-15:15

In Silico Therapeutic Antibody Design

UserCharlotte Deane, University of Oxford.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 29 April 2015, 15:30-16:30

Nested Sampling for bulk materials

UserGabor Csanyi, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 18 February 2015, 14:15-15:15

Modelling by Natural Moves

UserPeter Minary, University of Oxford.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 11 February 2015, 14:15-15:15

Sampled Energy Landscapes: Analysis and Comparison

UserFrederic Cazals, Inria Sophia-Antipolis, Algorithms-Biology-Structure.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 04 February 2015, 14:15-15:15

Catalysis on Steroids: A Journey into an Enzyme’s Active Site

UserStephen Fried, University of Cambridge.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 21 January 2015, 14:15-15:15

Density functional theory for molecules in magnetic fields

UserDr Andy Teale (University of Nottingham).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 12 November 2014, 14:15-15:15

Molecular random tilings

UserProfessor Juan Garrahan (University of Nottingham).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 29 October 2014, 14:15-15:15

Centre for Molecular Science Informatics

Interacting with Protein Interactions

"Special Event" Cambridge Cheminformatics Network Meetings

UserProfessor Arthur J Olson, Departmen of Interactive Structure & Computational BIology, The Scripps Research Institute, La Jolla CA.

HousePfizer Lecture Theatre Department of Chemistry Lensfield Road Cambridge Cambridgeshire CB2 3RA.

ClockWednesday 09 July 2014, 16:00-17:00

Centre for Molecular Science Informatics

"CADD & ENAC - A bad hand at Scrabble..?"

Please note that the date of this seminar has been changed

UserDr Peter Hunt, Optibrium Ltd.

HouseUnilever Lecture Theatre, Department of Chemistry.

ClockTuesday 03 June 2014, 14:15-15:45

Faceting of multicomponent elastic vesicles

UserDr Rastko Sknepnek (University of Dundee).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 21 May 2014, 14:15-15:15

Chirality in NMR Spectroscopy

UserProfessor David Buckingham FRS (University of Cambridge).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 14 May 2014, 14:15-15:15

Centre for Molecular Science Informatics

"From fragments to target-selective ligands by reaction-driven de novo design"

UserProfessor Gisbert Schneider. Institute of Pharmaceutical Sciences ETH Zurich.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockMonday 28 April 2014, 14:15-15:30

Centre for Molecular Science Informatics

Odorant space: From chemistry to physiology

UserDr Michael Schmuker, Neuroinformatics & Theoretical Neuroscience, Freie Universität Berlin.

HouseUnilever Lecture Theatre.

ClockTuesday 25 March 2014, 14:15-15:45

Computer simulation of peptide adsorption

UserProfessor Michael Allen (University of Warwick).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 12 March 2014, 14:15-15:15

Centre for Molecular Science Informatics

Protein-Ligand Binding by Free Energy Simulations: Issues, Successes and Failures

Please note the change of date, one week earlier than originally planned

UserProfessor Jonathan Essex, University of Southampton.

HouseUnilever Lecture Theatre.

ClockTuesday 25 February 2014, 14:15-15:45

Quantum Mechanics without Wavefunctions

UserProfessor Emily Carter (Princeton University).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 12 February 2014, 14:15-15:15

Running Combustion Backwards: Fuels from Sunlight, From First Principles

The Linnett Lecture

UserProfessor Emily Carter (Princeton University).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockTuesday 11 February 2014, 16:00-17:00

Diffusion in confined systems

UserProfessor J. Miguel Rubi (University of Barcelona), Leverhulme Visiting Professor, Department of Chemistry Imperial College .

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 22 January 2014, 14:15-15:15

Modelling Energy Conversion at Interfaces: A Dynamical View

UserProfessor Karsten Reuter (Technische Universität München).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 04 December 2013, 14:15-15:15

CANCELLED

UserProfessor Jiri Vanicek (EPFL, Lausanne).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 06 November 2013, 14:15-15:15

Centre for Molecular Science Informatics

Protein-Ligand Binding by Free Energy Simulations: Issues, Successes and Failures

We regret that due to illness this talk has been cancelled

UserProfessor Jonathan Essex, University of Southampton.

HouseUnilever Lecture Theatre.

ClockTuesday 15 October 2013, 12:00-13:30

Density functional theory as a framework to develop new methods

UserProfessor Andreas Savin (Université Pierre et Marie Curie, Paris VI).

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 09 October 2013, 14:15-15:15

Centre for Molecular Science Informatics

"Global Protein Structural Analysis for Drug Discovery"

UserDr Krishna Bulusu, from the Institute of Cancer Research (ICR).

HouseTodd Hamied Room, Department of Chemistry.

ClockTuesday 08 October 2013, 14:15-15:45

Physical Chemistry

Ionic Liquids: Applications in the Chemical-, Electro- and Bio- Sciences

UserDouglas R. MacFarlane Australian Centre for Electromaterials Science Monash University, Victoria, Australia.

HouseUnilever Lecture Theatre, Department of Chemistry.

ClockTuesday 16 July 2013, 12:00-13:00

Centre for Molecular Science Informatics

Approaching protein dynamics in the post-genome era

UserProfessor Modesto Orozco, Dept. Biochemistry & Molecular Biology, University of Barcelona .

HouseUnilever Lecture Theatre.

ClockTuesday 11 June 2013, 14:15-15:30

Solid Liquid Crystals and Soft Motors

UserProfessor Peter Palffy-Muhoray, Kent State University.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 05 June 2013, 14:15-15:15

Why Does Cyclobutane-1,2,3,4-tetraone Have a Triplet Ground State

UserProfessor Wes Borden, University of North Texas.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 22 May 2013, 14:15-15:15

Centre for Molecular Science Informatics

Why Does Cyclobutane-1,2,3,4-tetraone Have a Triplet Ground State?

A TMI RIG Presentation

UserProfessor Wes Borden, Unversity of Texas.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockWednesday 22 May 2013, 14:15-15:30

Numerically exact methods for nonequilibrium quantum impurity models

UserProfessor Eran Rabani, University of Tel Aviv.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 08 May 2013, 14:15-15:15

Centre for Molecular Science Informatics

Enzyme dynamics, conformations and catalysis

UserProfessor Adrian Mulholland, Centre for Computational Chemistry, Univeristy of Bristol.

HouseUnilever Lecture Theatre.

ClockTuesday 30 April 2013, 14:15-15:30

TB or not TB

Physical chemistry Linnett lecture series

UserProfessor Richard Zare (Stanford University).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockThursday 14 March 2013, 16:00-17:00

Searching for intermediates in liquid reactions

Physical chemistry Linnett lecture series

UserProfessor Richard Zare (Stanford University).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockTuesday 12 March 2013, 16:00-17:00

The Linnett Lecture: If you do not fail enough times, you can not possibly succeed

Linnett Lecture

UserProfessor Richard Zare (Stanford University).

HouseDepartment of Chemistry, Cambridge, Wolfson Lecture Theatre.

ClockTuesday 05 March 2013, 16:00-17:00

Centre for Molecular Science Informatics

“Data Driven Molecular Design & Discovery”

UserDr Scott Lusher, Netherlands eScience Centre.

HouseUnilever Lecture Theatre.

ClockThursday 21 February 2013, 11:00-12:00

Pushing the frontiers of wavefunction based ab initio quantum chemistry

UserProfessor Frank Neese (Max-Planck-Institute for Chemical Energy Conversion, Mülheim).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockMonday 11 February 2013, 16:00-17:00

Modeling of electrochemical interfaces at the atomic scale

UserProfessor Jan Rossmeisl (Technical University of Denmark, Lyngby).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 06 February 2013, 16:00-17:00

Theory, Dynamics, and Mechanisms of Cycloadditions

RSC Robert Robinson award Lecture

UserProfessor Kendall Houk (University of California, Los Angeles).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockThursday 17 January 2013, 16:00-17:00

Physical Chemistry

Title to be confirmed

UserDr Lucy Carpenter (University of York).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockMonday 03 December 2012, 16:00-17:00

Influence of the Topology of Single-Stranded RNAs on their Assembly in Viruses and Virus-like Particles

UserProfessor Paul van der Schoot (Technische Universiteit Eindhoven).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 21 November 2012, 14:15-15:15

Physical Chemistry

Watching Single Molecules

UserDavid Klenerman (University of Cambridge).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockMonday 19 November 2012, 16:00-17:00

Selective adsorption of ions to aqueous interfaces and its effects on evaporation rates

RSC Faraday Lecture

UserProfessor Richard Saykally (University of California, Berkeley).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 14 November 2012, 14:15-15:15

Centre for Molecular Science Informatics

"The mechanisms of solute flux through membrane channels from multi-microsecond equilibrium simulations"

UserDr Martin Ulmschneider, Dept. of Biological Sciences, Birkbeck College, University of London.

HouseUnilever Lecture Theatre.

ClockTuesday 30 October 2012, 14:15-15:30

Centre for Molecular Science Informatics

Successes and challenges in the prediction of P450 mediated drug metabolism

UserProfessor Patrik Rydberg, University of Copenhagen, Department of Drug Design and Pharmacology.

HouseUnilever Lecture Theatre.

ClockTuesday 04 September 2012, 14:00-15:30

Dynamics of Biomolecules: from the Glass Transition to Drug Design

UserProf. Jeremy Smith, Oak Ridge National Lab.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 20 June 2012, 14:15-15:15

Centre for Molecular Science Informatics

"Dynamics of Biomolecules: from the Glass Transition to Drug Design"

A joint Theory/UCC talk as part of the TMI Research Interest Group

UserProfessor Jeremy C Smith, Oak Ridge National Laboratory.

HousePfizer Lecture Theatre, Dept. of Chemistry.

ClockWednesday 20 June 2012, 14:15-15:30

Regenerating organs and other small challenges

[extra seminar]

UserProf. Molly Stevens, Imperial College.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockMonday 21 May 2012, 15:30-16:30

Topological Ring-Currents in Conjugated Systems

UserDr Roger Mallion, School of Physical Sciences, University of Kent.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 02 May 2012, 14:15-15:15

Theory and Simulation of Biomolecular Systems: Surmounting the Challenge of Bridging the Scales

Note unusual day

UserProf. Greg Voth, University of Chicago (CCP5 Lecturer).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockMonday 19 March 2012, 14:15-15:15

Understanding the Action of Proteins

Note unusual day

UserProf. Peter Bolhuis, University of Amsterdam (CCP5 Lecturer).

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockThursday 15 March 2012, 14:15-15:15

How entropic forces can drive chromosome organisation

UserProf. Bela Mulder, FOM Institute AMOLF.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 07 March 2012, 14:15-15:15

Physical Chemistry

Mechanical Atom Manipulation: Towards a Matter Compiler

UserProfessor Philip Moriarty, University of Nottingham.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 21 February 2012, 16:15-17:15

Crystal energetics through quantum embedding

UserProf. Fred Manby, University of Bristol.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 01 February 2012, 14:15-15:15

Centre for Molecular Science Informatics

Lessons from Yeast: Drug Uptake and Systems Biology

UserDr Paul D Dobson, Department of Chemical & Biological Engineering, University of Sheffield.

HouseUnilever Lecture Theatre.

ClockTuesday 31 January 2012, 14:00-15:30

Mechanostability of proteins and virus capsids

UserProf. Marek Cieplak, Polish Academy of Sciencies.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 18 January 2012, 14:15-15:15

How fast folding proteins fold

UserProf. Kresten Lindorff-Larsen, University of Copenhagen.

HouseDepartment of Chemistry, Cambridge, Pfizer lecture theatre.

ClockWednesday 23 November 2011, 14:15-15:15

Linnett Lecture: "Beyond Landscapes--the Far-from Equilibrium Cell"

UserProf. Peter Wolynes, Rice University.

HouseDept. of Chemistry, Pfizer Lecture Theatre.

ClockFriday 11 November 2011, 16:00-17:00

Linnett Lecture: "The Theory of the Structural Glass Transition"

Joint Theory/Biological Seminar

UserProf. Peter Wolynes, Rice University.

HouseDept. of Chemistry, Pfizer Lecture Theatre.

ClockWednesday 09 November 2011, 14:15-15:15

Linnett Lecture: "Recent Successes of the Energy Landscape Theory of Protein Folding"

Joint Theory/Physical Seminar

UserProf. Peter Wolynes, Rice University.

HouseDept. of Chemistry, Pfizer Lecture Theatre.

ClockTuesday 08 November 2011, 16:00-17:00

Linnett Lecture: "Landscapes of Matter, Energy and Life"

UserProf. Peter Wolynes, Rice University.

HouseDept. of Chemistry, Pfizer Lecture Theatre.

ClockThursday 03 November 2011, 15:30-16:30

Physical Chemistry

Timescales of chemical reactions

UserProf. Mike J Pilling CBE, School of Chemistry, University of Leeds.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 25 October 2011, 16:15-17:15

Conformational dynamics of single protein molecules under load

Joint Theory/Biological Seminar

UserProf. Matthias Rief, Technische Universität München.

HouseDepartment of Chemistry, Cambridge, Unilever lecture theatre.

ClockWednesday 12 October 2011, 14:15-15:15

Centre for Molecular Science Informatics

"New Developments in Semiempirical MO Theory for Drug and Materials Design"

This Lecture is part of Professor Clark's MGMS Lecture tour

UserProfessor Tim Clark, Friedrich-Alexander-Universität Erlangen-Nürnberg, Germany.

HousePfizer Lecture Theatre, Dept. of Chemistry.

ClockThursday 22 September 2011, 14:00-15:30

ac313's list

Molecular Simulations in Structure-Based Drug Design

UserDr Julien Michel, Royal Society University Research Fellow, School of Chemistry, University of Edinburgh.

HouseTodd-Hamied Room, Department of Chemistry.

ClockThursday 07 July 2011, 15:30-16:30

Theoretical Chemistry

What's wrong with density-functional theory?

UserProfessor Nicola Marzari, University of Oxford.

HouseUnilever Lecture Theatre, Department of Chemistry.

ClockWednesday 08 June 2011, 14:15-15:15

Theoretical Chemistry

Simulations of ionic liquids for energy applications

UserProfessor Mathieu Salanne, Université Pierre et Marie Curie.

HouseUnilever Lecture Theatre, Department of Chemistry.

ClockWednesday 01 June 2011, 14:15-15:15

Centre for Molecular Science Informatics

Exploring free-energy landscapes

UserProfessor Daan Frenkel FRS, Cambridge University Centre for Computational Chemistry, Department of Chemistry.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockThursday 19 May 2011, 15:30-16:30

Centre for Molecular Science Informatics

The power of coarse-graining in biomolecular simulations

UserProfessor Siewert-Jan Marrink, Groningen Biomolecular Sciences and Biotechnology Institute.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockThursday 19 May 2011, 14:00-15:30

Theoretical Chemistry

Soft matter physics and bacteria

UserProfessor Gerard Wong, UCLA and the University of Illinois.

HouseUnilever Lecture Theatre, Department of Chemistry.

ClockWednesday 11 May 2011, 14:15-15:15

Theoretical Chemistry

An Ising-like Model for Protein Folding

UserDr William Eaton, Laboratory of Chemical Physics, NIDDK, National Institutes of Health, USA.

HouseWolfson Lecture Theatre, Department of Chemistry.

ClockWednesday 20 April 2011, 14:15-15:15

Theoretical Chemistry

The theory of single molecule force and fluorescence spectroscopy

UserDr Attila Szabo, Laboratory of Chemical Physics, NIDDK, National Institutes of Health, USA.

HouseWolfson Lecture Theatre, Department of Chemistry.

ClockWednesday 13 April 2011, 14:15-15:15

Physical Chemistry

RSC Faraday Lecture

The Molecular Dance in Surface Reactions Followed a-Molecule-at-a-Time by STM

UserProfessor John Polanyi, University of Toronto.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockThursday 07 April 2011, 16:15-17:15

Inorganic Chemistry

Modelling synthesis and catalytic applications of doped AlPOs

Inorganic/Theoretical Joint Seminar

UserDr Furio Cora, University College London.

HouseUnilever Lecture Theatre, Department of Chemistry.

ClockMonday 14 March 2011, 15:30-16:30

Physical Chemistry

Physical Chemistry Graduate Seminar

UserDavid Madden, Matthew Ashford, Isabella Stocker.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockFriday 11 March 2011, 16:00-17:00

Physical Chemistry

Vehicle exhaust nanoparticles: sources and control.

UserDr Martyn Twigg - previously Chief Scientist of Johnson Matthey.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 08 March 2011, 16:15-17:15

Physical Chemistry

What surfactants do at interfaces

UserProfessor Robert Thomas, University of Oxford.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 01 March 2011, 16:15-17:15

Centre for Molecular Science Informatics

Neurotransmitter transporters: from ligand-based to systems chemical biology approaches

UserProfessor Olivier Taboureau, Center for Biological Sequence Analysis, Technical University of Denmark.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockTuesday 22 February 2011, 14:15-15:30

Theoretical Chemistry

Under pressure: quasi-high pressure effects in nano-pores

UserProfessor Keith Gubbins, North Carolina State University.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 09 February 2011, 14:15-15:15

Theoretical Chemistry

Geometrical aspects of hydrophobic hydration

UserDr Joachim Dzubiella, Technische Universität München.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 26 January 2011, 14:15-15:15

Theoretical Chemistry

Title to be confirmed

UserDr Giovanni Bussi, Statistical and Biological Physics Sector, SISSA, Trieste.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 01 December 2010, 14:15-15:15

Theoretical Chemistry

Quantum dynamics of chemical reactions

Royal Society of Chemistry Liversidge Lecture

UserProfessor David Clary FRS, University of Oxford.

HouseWolfson Lecture Theatre, Department of Chemistry.

ClockWednesday 24 November 2010, 14:15-15:15

Centre for Molecular Science Informatics

"Visualising and Predicting Organic Reactivity"

UserDr Scott L Cockroft, Lecturer in Organic Chemistry, University of Edinburgh.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockTuesday 23 November 2010, 14:15-15:30

Theoretical Chemistry

Title: From coarse-grained models of fibril formation to atomistic details of potential inhibitors

Joint Theoretical/Biophysical Colloquium *** NOTE: UNUSUAL TIME: 10:30 AM ***

UserAmedeo Caflish, University of Zurich.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 17 November 2010, 10:30-11:30

Physical Chemistry

Polymeric Multilayer Capsules in Materials- and Biosciences

UserBP Visiting Lecturer Prof. Helmuth Möhwald, Max Planck Institute of Colloids and Interfaces.

HouseBP Institute, Madingley Rise, Madingley Road, Cambridge.

ClockThursday 11 November 2010, 11:30-12:30

Physical Chemistry

Multifunctional Polymer Films and Coatings

UserBP Visiting Lecturer Prof. Dr. Dr. h.c., Helmuth Möhwald, Max Planck Institute of Colloids and Interfaces.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockWednesday 10 November 2010, 14:30-15:30

Theoretical Chemistry

Metal-mediated molecular traps and junctions: a computational design

UserDr Fedor Naumkin, University of Ontario Institute of Technology.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 10 November 2010, 14:15-15:15

Physical Chemistry

Amphiphide Monolayers to study interfacial interactions

There will be a reception following this lecture in the Todd Hamied.

UserBP Visiting Lecturer Prof. Dr. Dr. h.c., Helmuth Möhwald, Max Planck Institute of Colloids and Interfaces.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 09 November 2010, 14:30-15:30

Theoretical Chemistry

Gaussian Approximation Potentials: quantum mechanical accuracy without electrons

UserDr Gabor G. Csányi, Engineering Laboratory, University of Cambridge.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 03 November 2010, 14:15-15:15

Physical Chemistry

"From clays to the cytosol - approaches for characterising soft matter"

UserProfessor Athene Donald ( Director, Physics of Medicine, Cavendish Laboratory).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 19 October 2010, 16:15-17:15

Centre for Molecular Science Informatics

Application of Informatics within Unilever

UserDr Ian Stott, Informatics & Maths Leader, Unilever R & D, Port Sunlight.

HouseTodd Hamied Room, Dept. of Chemistry.

ClockWednesday 13 October 2010, 14:15-15:30

Centre for Atmospheric Science seminars, Chemistry Dept.

Atmospheric Reactions of Peroxy Radicals – Key Intermediates in Ozone Formation and Loss

NOTE unusual DAY and LOCATION Joint with Physical Chemistry

UserDr Geoff Tyndall, NCAR Colorado USA.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 12 October 2010, 14:15-15:15

Theoretical Chemistry

LeuRS Synthetase: An example of water-mediated editing reaction in a hybrid RNA/protein system

UserDr Mauro Boero, University of Strasbourg, Institut de Physique et Chimie des Materiaux de Strasbourg (IPCMS).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 06 October 2010, 14:15-15:15

Centre for Molecular Science Informatics

Past, present, and future of semiempirical methods

UserDr James J P Stewart, Stewart Computational Chemistry, Colorado Springs, USA.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockThursday 16 September 2010, 14:15-15:30

Centre for Molecular Science Informatics

In Silico Drug discovery and molecular library focusing

UserProfessor Amiram Goldblum, The Institute of Drug Research, Faculty of Medicine The Hebrew University of Jerusalem.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockWednesday 30 June 2010, 16:00-17:30

Theoretical Chemistry

Symmetry, equivalence and molecular self-organisation

UserDr Jack Douglas, National Institute of Standards & Technology (NIST).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 19 May 2010, 14:15-15:15

Theoretical Chemistry

Free Energy methods to study complex biological phenomena

UserDr Francesco Gervasio, Spanish National Cancer Research Centre, Madrid.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 05 May 2010, 14:15-15:15

Theoretical Chemistry

Anomalous Liquids

UserProfessor Giancarlo Franzese, University of Barcelona.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 28 April 2010, 14:15-15:15

Theoretical Chemistry

Fluctuation induced forces: The critical Casimir effect

UserProfessor Clemens Bechinger, Universität Stuttgart.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 17 February 2010, 14:15-15:15

Theoretical Chemistry

No Lecture as Royal Society of Chemistry Meeting

UserSpeaker to be confirmed.

HouseVenue to be confirmed.

ClockWednesday 10 February 2010, 00:00-00:00

Centre for Molecular Science Informatics

Machine like functions at the molecular level

UserProf. Dr. Rainer Herges, Otto-Diels-Institut für Organische Chemie, Universität zu Kiel.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockTuesday 19 January 2010, 14:15-15:15

Theoretical Chemistry

Ions at Aqueous Interfaces: From Water Surface to Hydrated Proteins

UserProfessor Pavel Jungwirth, Academy of Sciences of the Czech Republic.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 13 January 2010, 14:15-15:15

Theoretical Chemistry

Long Range Magnetic Interactions in Pure Carbon Materials

UserProfessor Nicholas M Harrison, Imperial College of Science, Technology and Medicine, London.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 25 November 2009, 14:15-15:15

Theoretical Chemistry

Modeling Protein Aggregation

UserProfessor Srikanth Sastry, Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 18 November 2009, 14:15-15:15

Centre for Molecular Science Informatics

Crawling Across the Web of Chemistry Using ChemSpider

UserDr Antony Williams, VP Strategic Development, ChemSpider, RSC, Wake Forest USA.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockTuesday 17 November 2009, 14:15-15:15

Theoretical Chemistry

Explicit and implicit microion representations of dispersions of oppositely charged nanoparticles: expectations and surprises

UserProfessor Jean-Pierre Hansen FRS, Emeritus 1968 Professor of Chemistry, Cambridge and Emeritus Professor of Physics, Ecole Normale Supérieure de Lyon.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 11 November 2009, 14:15-15:15

Theoretical Chemistry

Hydrogen bonding structure and ultrafast dynamics of bulk, interfacial, and confined water

(Joint Theory/Physical Seminar)

UserProfessor James L Skinner, University of Wisconsin.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockWednesday 04 November 2009, 14:15-15:15

Theoretical Chemistry

Single-molecule force spectroscopy: theory, analysis, interpretation

UserProfessor Olga K Dudko, University of California at San Diego.

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 28 October 2009, 14:15-15:15

Centre for Molecular Science Informatics

"Calculating selectivities in homogeneous catalysis"

UserProfessor Per-Ola Norrby, Department of Chemistry, University of Gothenburg,.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Dept. of Chemistry.

ClockTuesday 13 October 2009, 14:15-15:15

Centre for Molecular Science Informatics

Nanofluidics

UserProfessor Nick Quirke, Nano-bio Physics, University College Dublin.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Department of Chemist.

ClockTuesday 26 May 2009, 14:15-15:15

Physical Chemistry

Redox chemistry of diamond

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserDr Katherine Holt (University College London).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 10 March 2009, 14:15-15:15

Physical Chemistry

Graduate Student Seminars

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserRachel Pike, Amy Stevens.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 03 March 2009, 14:15-15:15

Physical Chemistry

Graduate Student Seminars

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserNeil Dickson, Tamsin Phillips.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 24 February 2009, 14:15-15:15

Physical Chemistry

Graduate Student Seminars

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserAndrew Cassidy, Paul Dunne.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 17 February 2009, 14:15-15:15

Physical Chemistry

It's not (all) --rocket-- atmospheric science

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserProfessor John Pyle (University of Cambridge).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 10 February 2009, 14:15-15:15

Physical Chemistry

Density functional simulation of a fast-ion conducting glass

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserProfessor David Drabold (Ohio University).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 03 February 2009, 14:15-15:15

Physical Chemistry

Bionanoscience

UserProfessor Gil Lee – University College Dublin.

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 27 January 2009, 14:15-15:15

Theoretical Chemistry

Understanding glass transition on the basis of elastic interactions in a liquid

http://www.ch.cam.ac.uk/events/colloquia/theo.html

UserProfessor Kostya Trachenko (Department of Earth Sciences, University of Cambridge).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 21 January 2009, 14:15-15:15

Physical Chemistry

How physics can be applied to biological problems

http://www.ch.cam.ac.uk/events/colloquia/phys.html

UserDr Pietro Cicuta (University of Cambridge).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 20 January 2009, 16:15-17:15

Theoretical Chemistry

Exchange and Dynamic Correlation

UserProfessor Nicholas Handy FRS (Department of Chemistry, University of Cambridge).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 03 December 2008, 14:15-15:15

Theoretical Chemistry

Multiscale modelling of catalytic nanoparticles for CNT synthesis

UserDr James Elliot (Department of Materials Science & Metallurgy, University of Cambridge).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 19 November 2008, 14:15-15:15

Physical Chemistry

Chemical Activity on Graphene Under Stress

UserDr Pedro de Andres (CSIC, Madrid).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 18 November 2008, 16:15-17:15

Theoretical Chemistry

Intermolecular Coulombic Decay and Ultrafast Energy Transfer

UserProfessor Lorenz Cederbaum (University of Heidelberg).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 12 November 2008, 14:15-15:15

Physical Chemistry

Accelerating Chemistry & Biology: Intelligent Microfluidics

UserProfessor Andrew de Mello (Imperial College).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 11 November 2008, 16:15-17:15

Theoretical Chemistry

Non-equilibrium phase transitions in complex systems

UserDr Sergei Taraskin (Department of Chemistry, University of Cambridge).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 05 November 2008, 14:15-15:15

Centre for Molecular Science Informatics

Predicting Molecular Properties: the Role of Data Visualisation and Feature Selection

UserProf. Ian Nabney, Neural Computing Research Group, School of Engineering and Applied Science, Aston University.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Department of Chemist.

ClockTuesday 04 November 2008, 14:15-15:15

Physical Chemistry

Atmospheric Aerosols: Their Effect on Climate and on Human Health

UserDr Markus Kalberer (University of Cambridge).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 04 November 2008, 14:15-15:15

Theoretical Chemistry

Cold Molecules: Production and Control

UserProfessor Jeremy Hutson (University of Durham).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 29 October 2008, 14:15-15:15

Physical Chemistry

Particle Engineering: Role of Surface Chemistry

UserDr Jerry Heng (Imperial College).

HousePfizer Lecture Theatre, Department of Chemistry.

ClockTuesday 28 October 2008, 14:15-15:15

Theoretical Chemistry

Entropy as an ordering force

Inaugural Lecture

UserProfessor Daan Frenkel FMRS (Department of Chemistry, University of Cambridge).

HouseWolfson Lecture Theatre, Department of Chemistry.

ClockWednesday 22 October 2008, 14:15-15:15

Theoretical Chemistry

Dynamics on the way to forming glass: past, present and future

UserProfessor David Chandler (University of California at Berkeley).

HouseWolfson Lecture Theatre, Department of Chemistry.

ClockWednesday 15 October 2008, 14:15-15:15

Theoretical Chemistry

Quantum transitions in Lennard-Jones clusters

UserProfessor Vladimir Mandelshtam (University of Southern California).

HouseUnilever Lecture Theatre, Unilever Centre, Department of Chemistry.

ClockWednesday 08 October 2008, 14:15-15:15

Centre for Molecular Science Informatics

Representation and predictive modeling of complex biomolecular datasets

UserProf. Alexander Tropsha, School of Pharmacy, The University of North Carolina at Chapel Hill.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Department of Chemist.

ClockFriday 26 September 2008, 14:00-15:00

Centre for Molecular Science Informatics

Developing Quantum Topological Molecular Similarity (QTMS)

UserDr. Paul Popelier, School of Chemistry, University of Manchester.

HouseWolfson Lecture Theatre, Department of Chemistry.

ClockTuesday 29 April 2008, 14:15-15:15

Centre for Molecular Science Informatics

Using Ontology to Classify Members of a Protein Family

UserDr. Robert Stevens, School of Computer Science, University of Manchester.

HouseTodd-Hamied Room, Department of Chemistry.

ClockMonday 14 April 2008, 14:15-15:15

Centre for Molecular Science Informatics

Analysis of Antibody Sequence and Structure

UserDr. Andrew Martin, Dept. of Biochemistry and Molecular Biology, University College London.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Department of Chemist.

ClockTuesday 19 February 2008, 14:15-15:15

Centre for Molecular Science Informatics

QM to QSAR

UserProf. Jonathan Hirst, School of Chemistry, University of Nottingham.

HouseUnilever Lecture Theatre, Unilever Centre for Molecular Informatics, Department of Chemist.

ClockTuesday 12 February 2008, 14:15-15:15

Please see above for contact details for this list.

 

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