Search Result "Protein conformational ensembles"


Artificial Neural Networks for Efficient Clustering of Conformational Ensembles and their Potential for Medicinal Chemistry

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 5 Year: 2013 Page: 642-651
Author(s): Alessandro Pandini, Domenico Fraccalvieri, Laura Bonati

Probing Dynamic Protein Ensembles with Atomic Proximity Measures

Journal: Current Protein & Peptide Science
Volume: 11 Issue: 7 Year: 2010 Page: 515-522
Author(s): Zoltan Gaspari, Annamaria F. Angyan, Somdutta Dhir, Dino Franklin, Andras Perczel, Alessandro Pintar, Sandor Pongor

Allosteric Coupling and Conformational Fluctuations in Proteins

Journal: Current Protein & Peptide Science
Volume: 10 Issue: 2 Year: 2009 Page: 110-115
Author(s): H. Ongun Onaran, Tommaso Costa

Generalized-Ensemble Algorithms for Protein Folding and Unfolding

Journal: Current Physical Chemistry
Volume: 2 Issue: 1 Year: 2012 Page: 92-106
Author(s): Yuko Okamoto

Insights into the Conformational Ensemble of Human Islet Amyloid Polypeptide from Molecular Simulations

Journal: Current Pharmaceutical Design
Volume: 22 Issue: 2 Year: 2016 Page: 3601-3607
Author(s): Linh Tran, Tap Ha-Duong

Single-Molecule Protein Interaction Conformational Dynamics

Journal: Current Pharmaceutical Biotechnology
Volume: 10 Issue: 5 Year: 2009 Page: 522-531
Author(s): H. Peter Lu

Protonation States and Conformational Ensemble in Ligand-based QSAR Modeling

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 2 Year: 2013 Page: 4323-4329
Author(s): Pier G. De Benedetti

Recognition-induced Conformational Changes in Protein-Protein Docking

Journal: Current Pharmaceutical Biotechnology
Volume: 9 Issue: 2 Year: 2008 Page: 77-86
Author(s): M. F. Lensink, R. Mendez

Conformational Sampling Techniques

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 2 Year: 2014 Page: 3303-3313
Author(s): Marcus P. D. Hatfield, Sandor Lovas

Modeling Ensembles of Loop Conformations by Iterative Stochastic Elimination

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 7 Year: 2016 Page: 646-651
Author(s): Amit Michaeli, Anwar Rayan

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