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European Journal of Medicinal Chemistry|March 16, 2010
Post-docking virtual screening of diverse binding pockets: comparative study using DOCK, AMMOS, X-Score and FRED scoring functionsTania Pencheva, Oumarou Samna Soumana, Ilza Pajeva, et al.
Current Computer-Aided Drug Design|October 31, 2012
Post-docking optimization and analysis of protein-ligand interactions of estrogen receptor alpha using AMMOS softwareTania Pencheva, Dessislava Jereva, Maria A Miteva, et al.
BMC Bioinformatics|October 18, 2008
AMMOS: Automated Molecular Mechanics Optimization tool for in silico ScreeningTania Pencheva, David Lagorce, Ilza Pajeva, et al.
Nucleic Acids Research|May 10, 2017
AMMOS2: a web server for protein-ligand-water complexes refinement via molecular mechanicsCéline M Labbé, Tania Pencheva, Dessislava Jereva, et al.
International Journal of Molecular Sciences|September 25, 2019
A Free Web-Based Protocol to Assist Structure-Based Virtual Screening ExperimentsNathalie Lagarde, Elodie Goldwaser, Tania Pencheva, et al.
European Biophysics Journal : EBJ|March 28, 2008
Insight into the recognition patterns of the ErbB receptor family transmembrane domains: heterodimerization models through molecular dynamics searchOumarou Samna Soumana, Norbert Garnier, Monique Genest
European Biophysics Journal : EBJ|July 25, 2007
Molecular dynamics simulation approach for the prediction of transmembrane helix-helix heterodimers assemblyOumarou Samna Soumana, Norbert Garnier, Monique Genest
Natural Product Communications|November 15, 2018
ADME/Tox Properties and Biochemical Interactions of Silybin Congeners: In silico StudyAntonia Diukendjieva, Merilin Al Sharif, Petko Alov, et al.
Molecules (Basel, Switzerland)|November 13, 2021
Computational Analysis of Chemical Space of Natural Compounds Interacting with SulfotransferasesIglika Lessigiarska, Yunhui Peng, Ivanka Tsakovska, et al.
Journal of Biomolecular Structure & Dynamics|May 28, 2005
Transmembrane peptides from tyrosine kinase receptor. Mutation-related behavior in a lipid bilayer investigated by molecular dynamics simulationsOumarou Samna Soumana, Pierre Aller, Norbert Garnier, et al.
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