Search Result "binding energy prediction."
The Linear Interaction Energy Method for Predicting Ligand Binding Free Energies
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 4 Issue: 8 Year: 2001 Page: 613-626
Author(s): Johan Aqvist, John Marelius
Estimation of the Binding Free Energy by Linear Interaction Energy Models
Journal: Mini-Reviews in Medicinal Chemistry
Volume: 12 Issue: 6 Year: 2012 Page: 551-561
Author(s): O. Nicolotti,M. Convertino,F. Leonetti,M. Catto,S. Cellamare,A. Carotti
Tuning the Solvation Term in the MM-PBSA/GBSA Binding Affinity Predictions
Ebook: Frontiers in Computational Chemistry
Volume: 1 Year: 2015
Author(s): Irene Maffucci,Alessandro Contini
Doi: 10.2174/9781608058648115010005
Proteochemometrics for the Prediction of Binding to the MHC Proteins
Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 1 Year: 2017 Page: 2-9
Author(s): Ventsislav Yordanov,Ivan Dimitrov,Irini Doytchinova
Molecular Recognition and Binding Free Energy Calculations in Drug Development
Journal: Current Pharmaceutical Biotechnology
Volume: 9 Issue: 2 Year: 2008 Page: 87-95
Author(s): B. N. Dominy
Analyzing and Predicting Protein Binding Pockets
Ebook: In Silico Lead Discovery
Volume: 1 Year: 2011
Author(s): Rooplekha C. Mitra,Emil Alexov
Doi: 10.2174/978160805142711101010084
Identifying Protein-Protein Binding Sites with a Combined Energy Function
Journal: Current Protein & Peptide Science
Volume: 15 Issue: 6 Year: 2014 Page: 540-552
Author(s): Fei Guo,Shuai C. Li,Ying Fan,Lusheng Wang
In Silico Prediction of Binding Sites on Proteins
Journal: Current Medicinal Chemistry
Volume: 17 Issue: 1 Year: 2010 Page: 1550-1562
Author(s): Simon Leis, Sebastian Schneider, Martin Zacharias
A Critical Review of Validation, Blind Testing, and Real- World Use of Alchemical Protein-Ligand Binding Free Energy Calculations
Journal: Current Topics in Medicinal Chemistry
Volume: 17 Issue: 23 Year: 2017 Page: 2577-2585
Author(s): Robert Abel,Lingle Wang,David L. Mobley,Richard A. Friesner
Prediction of MHC-Peptide Binding: A Systematic and Comprehensive Overview
Journal: Current Pharmaceutical Design
Volume: 15 Issue: 2 Year: 2009 Page: 3209-3220
Author(s): Esther M. Lafuente, Pedro A. Reche