Search Result "local move Monte Carlo sampling"

Molecular Docking: A Powerful Approach for Structure-Based Drug Discovery

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 2 Year: 2011 Page: 146-157
Author(s): Xuan-Yu Meng, Hong-Xing Zhang, Mihaly Mezei, Meng Cui

Conformational Sampling Techniques

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3303-3313
Author(s): Marcus P. D. Hatfield,Sandor Lovas

The Early Events of the Protein Folding Process

Journal: Current Physical Chemistry
Volume: 3 Issue: 1 Year: 2013 Page: 69-76
Author(s): J. P. Dal Molin,Antonio Caliri

Local Protein Structures

Journal: Current Bioinformatics
Volume: 2 Issue: 3 Year: 2007 Page: 165-202
Author(s): Bernard Offmann, Manoj Tyagi, Akexandre G. de Brevern

Thermal Motions of the E. coli Glucose-Galactose Binding Protein Studied Using Well-Sampled Semi-Atomistic Simulations

Journal: Current Topics in Medicinal Chemistry
Volume: 11 Issue: 2 Year: 2011 Page: 211-220
Author(s): D. J. Cashman, A. B. Mamonov, D. Bhatt, D. M. Zuckerman

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

Role of Ensemble Conformational Sampling Using Molecular Docking & Dynamics in Drug Discovery

Ebook: Frontiers in Computational Chemistry
Volume: 6 Year: 2022
Author(s):
Doi: 10.2174/9789815036848122060004

What Can We Learn from Single Molecule Trajectories?

Journal: Current Protein & Peptide Science
Volume: 12 Issue: 8 Year: 2011 Page: 714-724
Author(s): Verena Ruprecht, Markus Axmann, Stefan Wieser, Gerhard J. Schutz

Elucidating Allosteric Communications in Proteins via Computational Methods

Ebook: Frontiers in Computational Chemistry
Volume: 3 Year: 2017
Author(s): Burak Alakent,Z. Nevin Gerek Ince
Doi: 10.2174/9781681081670117030006

Research Article

Determination of Gamma Camera’s Calibration Factors for Quantitation of Diagnostic Radionuclides in Simultaneous Scattering and Attenuation Correction

Journal: Current Radiopharmaceuticals
Volume: 12 Issue: 1 Year: 2019 Page: 29-39
Author(s): Afrouz Asgari,Mansour Ashoor,Leila Sarkhosh,Abdollah Khorshidi,Parvaneh Shokrani

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