Computational Modelling Group
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Research
Multipole methods
Events
Past Events related to Multipole methods
Below are the events that have been offered though the CMG in the past.
May 2013
10th May
4:00 p.m.
'Computational Photochemistry in Action: Charges, Crossings and Control
April 2013
26th April
4:00 p.m.
Modelling hydration in simple and complex systems with inhomogeneous fluid solvation theory
June 2012
1st June
4:00 p.m.
Simulations of conformational dynamics along the p53-mdm2 pathway
April 2012
27th April
2:00 p.m.
Computational challenges in wavefunction-based electronic structure theory
13th April
4:00 p.m.
First-principles vibrational spectroscopy and lattice dynamics of materials in the solid state
March 2012
16th March
2:00 p.m.
Theory and Simulation of Biomolecular Systems: Surmounting the Challenge of Bridging the Scales
December 2011
13th December
2:00 p.m.
Analyzing biomacromolecular flexibility by constraint counting
November 2011
30th November
1:00 p.m.
Overcoming frustration with local elevation: enhancing the sampling in biomolecular simulations biased with experimental data
September 2011
23rd September
2:00 p.m.
New Developments in Semiempirical MO Theory for Drug and Materials Design. (MGMS Lecture Tour Seminar)
March 2011
22nd March
4:00 p.m.
Computational biochemistry: understanding biomolecular mechanisms by modelling