Search Result "ligand-binding model"


Compound Activity Prediction Using Models of Binding Pockets or Ligand Properties in 3D

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 17 Year: 2012 Page: 1869-1882
Author(s): Irina Kufareva,Yu-Chen Chen,Andrey V. Ilatovskiy,Ruben Abagyan

Binding Free Energy Estimation for Protein-Ligand Complex Based on MM-PBSA with Various Partial Charge Models

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 12 Year: 2013 Page: 2293-2307
Author(s): Ting Fu,Zhong Jin,Zhilong Xiu,Guohui Li

Cu-Complexes with Scorpionate Ligands as Models for the Binding Sites of Copper Proteins

Journal: Current Bioactive Compounds
Volume: 5 Issue: 4 Year: 2009 Page: 244-263
Author(s): Marcello Gennari, Luciano Marchio

Identification of Ligand Binding Pockets on Nuclear Receptors by Machine Learning Methods

Journal: Protein & Peptide Letters
Volume: 21 Issue: 8 Year: 2014 Page: 808-814
Author(s): Ninad Oak,V.K. Jayaraman

Identification of Ligand-Binding Pockets in Proteins Using Residue Preference Methods

Journal: Protein & Peptide Letters
Volume: 16 Issue: 8 Year: 2009 Page: 984-990
Author(s): Zhijun Qiu, Xicheng Wang

Ligand Binding Domain of Vitamin D Receptors

Journal: Current Topics in Medicinal Chemistry
Volume: 6 Issue: 1 Year: 2006 Page: 1229-1241
Author(s): Natacha Rochel, Dino Moras

Ligand-Gated Pentameric ion Channels, from Binding to Gating

Journal: Current Molecular Pharmacology
Volume: 2 Issue: 3 Year: 2009 Page: 253-262
Author(s): Gabor Maksay

Computational Methods for Calculation of Ligand-Binding Affinity

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1031-1039
Author(s): Walter Filgueira de Azevedo Jr., Raquel Dias

Review Article

Supervised Machine Learning Methods Applied to Predict Ligand- Binding Affinity

Journal: Current Medicinal Chemistry
Volume: 24 Issue: 23 Year: 2017 Page: 2459-2470
Author(s): Gabriela S. Heck,Val O. Pintro,Richard R. Pereira,Mauricio B. de Ávila,Nayara M.B. Levin,Walter F. de Azevedo

Improved Prediction of Protein Ligand-Binding Sites Using Random Forests

Journal: Protein & Peptide Letters
Volume: 18 Issue: 1 Year: 2011 Page: 1212-1218
Author(s): Zhijun Qiu, Xicheng Wang

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