Search Result "local move Monte Carlo sampling"


Conformational Sampling and Energetics of Drug-Like Molecules

Journal: Current Medicinal Chemistry
Volume: 16 Issue: 2 Year: 2009 Page: 3381-3413
Author(s): Nicolas Foloppe, I-Jen Chen

Membrane Deformation at Integrin Adhesions

Journal: Current Pharmaceutical Biotechnology
Volume: 10 Issue: 5 Year: 2009 Page: 508-514
Author(s): Erdinc Atilgan, Ben Ovryn

Modeling Reality for Optimal Docking of Small Molecules to Biological Targets

Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 4 Year: 2009 Page: 241-263
Author(s): Christopher R. Corbeil, Eric Therrien, Nicolas Moitessier

A Guide to Template Based Structure Prediction

Journal: Current Protein & Peptide Science
Volume: 10 Issue: 3 Year: 2009 Page: 270-285
Author(s): Xiaotao Qu, Rosemarie Swanson, Ryan Day, Jerry Tsai

Protein Domains as Information Processing Units

Journal: Current Protein & Peptide Science
Volume: 10 Issue: 2 Year: 2009 Page: 133-145
Author(s): Tom Lenaerts, Joost Schymkowitz, Frederic Rousseau

Molecular Modeling Studies of ABC Transporters Involved in Multidrug Resistance

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 9 Issue: 2 Year: 2009 Page: 186-193
Author(s): Aina Westrheim Ravna, Georg Sager

Inspection of Mechanical Tolerance by Using the Virtual Gauge on a Coordinate Measuring Machine

Journal: Recent Patents on Computer Science
Volume: 2 Issue: 2 Year: 2009 Page: 135-144
Author(s): Salim Boukebbab, Jean M. Linares, Med S. Boulahlib, Jean M. Sprauel

Basis for Resistance to Imatinib in 16 BCR-ABL Mutants as Determined Using Molecular Dynamics

Journal: Recent Patents on Anti-Cancer Drug Discovery
Volume: 4 Issue: 2 Year: 2009 Page: 164-173
Author(s): Tai-Sung Lee, Steven J. Potts, Maher Albitar

Simplified Computational Methods for the Analysis of Protein Flexibility

Journal: Current Protein & Peptide Science
Volume: 10 Issue: 6 Year: 2009 Page: 607-613
Author(s): Igor B. Kuznetsov

Molecular Dynamics Simulations of Kv Channels and Gating-Modifier Peptide Toxins

Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 3 Year: 2009 Page: 155-173
Author(s): Kazuhisa Nishizawa

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