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Grand Canonical Solute Sampling in Combination with the Site Identification by Ligand Competitive Saturation (SILCS) Ligand Design Methodology
Presenter
- Alex MacKerell
December 8, 2015
MBI
Re-building of the traffic model from non-equilibrium dynamics and partial observations
Presenter
- Alexandros Sopasakis
October 28, 2015
IPAM
Electrostatic interactions play important roles in kinesin proceeding on microtubule
Presenter
- Lin Li
October 15, 2015
MBI
Quantifying the influence of conformational uncertainty in biomolecular solvation
Presenter
- Nathan Baker
October 12, 2015
MBI
Multi-name default intensity models under stochastic time-change
Presenter
- Michael Gordy
March 25, 2015
IPAM
Quantum Chemistry Approaches to the Electron Correlation Problem
Presenter
- Ken Jordan
July 24, 2014
IPAM
Modelling Energy Conversion at Interfaces: Heat and mass transfer effects in in-situ model catalyst studies
Presenter
- Karsten Reuter
October 15, 2013
IPAM
Enhanced sampling in molecular dynamics: Unbiased approaches
Presenter
- Mark Tuckerman
September 11, 2013
IPAM