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Journal of Chemical Theory and Computation|November 21, 2015
PowerBorn: A Barnes-Hut Tree Implementation for Accurate and Efficient Born Radii ComputationMartin Brieg, Wolfgang WenzelJournal of Computational Chemistry|September 23, 2014
SLIM: an improved generalized Born implicit membrane modelJulia Setzler, Carolin Seith, Martin Brieg, et al.Physical Chemistry Chemical Physics : PCCP|December 21, 2016
Generalized Born implicit solvent models for small molecule hydration free energiesMartin Brieg, Julia Setzler, Steffen Albert, et al.Scientific Reports|October 24, 2020
Sampling of the conformational landscape of small proteins with Monte Carlo methodsNana Heilmann, Moritz Wolf, Mariana Kozlowska, et al.Journal of Colloid and Interface Science|August 9, 2021
Modelling peptide adsorption energies on gold surfaces with an effective implicit solvent and surface modelMikhail Suyetin, Saientan Bag, Priya Anand, et al.Journal of the American Chemical Society|December 23, 2004
Predictive in silico all-atom folding of a four-helix protein with a free-energy modelAlexander Schug, Wolfgang WenzelStructure (London, England : 1993)|April 20, 2005
Free-energy landscape of the villin headpiece in an all-atom force fieldThomas Herges, Wolfgang WenzelThe Journal of Chemical Physics|March 19, 2008
Conformational landscape of the HIV-V3 hairpin loop from all-atom free-energy simulationsAbhinav Verma, Wolfgang WenzelJournal of Chemical Theory and Computation|July 12, 2021
CONI-Net: Machine Learning of Separable Intermolecular Force FieldsManuel Konrad, Wolfgang WenzelBMC Structural Biology|March 21, 2007
Protein structure prediction by all-atom free-energy refinementAbhinav Verma, Wolfgang WenzelPageof 18