Search Result "solvated interaction energies (SIE)."
Solvation Models: Theory and Validation
Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3266-3280
Author(s): Enrico O. Purisima,Traian Sulea
Recent Advances in ProteinâLigand Interactions: Molecular Dynamics Simulations and Binding Free Energy
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 518-531
Author(s): Kshatresh Dutta Dubey,Rakesh Kumar Tiwari,Rajendra Prasad Ojha
Methods for Calculating the Entropy and Free Energy of Biological Systems
Ebook: Advances in Protein and Peptide Sciences
Volume: 1 Year: 2013
Author(s): Hagai Meirovitch
Doi: 10.2174/9781608054879113010013
Ibalizumab-Human CD4 Receptor Interaction: Computational Alanine Scanning Molecular Dynamics Studies
Journal: Current Computer-Aided Drug Design
Volume: 10 Issue: 3 Year: 2014 Page: 217-225
Author(s): Zhi-Yuan Su
Inhibitor and Substrate Binding by New Delhi metallo-beta-lactamase-1: A Molecular Dynamics Studies
Journal: Current Computer-Aided Drug Design
Volume: 10 Issue: 3 Year: 2014 Page: 197-204
Author(s): Yeng-Tseng Wang,Chi-Yu Lu,Tzyh-Chyuan Hour,Tian-Lu Cheng
Molecular Dynamics Simulation Reveal the Mechanism of Resistance of Mutant Actins to Latrunculin A â Insight into Specific Modifications to Design Novel Drugs to Overcome Resistance
Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 2 Year: 2016 Page: 107-118
Author(s): Roopa Lalitha,Pravin Kumar R.,M. M. Sudheer Mohammed
Structural Bioinformatics: Methods, Concepts and Applications to Blood Coagulation Proteins
Journal: Current Protein & Peptide Science
Volume: 3 Issue: 3 Year: 2002 Page: 341-364
Author(s): Bruno O. Villoutreix
Roles of Accelerated Molecular Dynamics Simulations in Predictions ofBinding Kinetic Parameters
Journal: Mini-Reviews in Medicinal Chemistry
Volume: 24 Issue: 14 Year: 2024 Page: 1323-1333
Author(s):
Structure Solution of Misfolded Conformations Adopted by Intrinsically Disordered Alzheimers Tau Protein
Journal: Protein & Peptide Letters
Volume: 16 Issue: 1 Year: 2009 Page: 61-64
Author(s): Jozef Sevcik, Rostislav Skrabana, Eva Kontsekova, Michal Novak
Computational Intelligence Methods for Docking Scores
Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 1 Year: 2009 Page: 56-68
Author(s): David Hecht, Gary B. Fogel