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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

Bio-Inspired Algorithms Applied to Molecular Docking Simulations

Journal: Current Medicinal Chemistry
Volume: 18 Issue: 9 Year: 2011 Page: 1339-1352
Author(s): G. Heberle, W. F. de Azevedo

Molecular Mapping and Docking Interactions for Selective Anti-Fertility Potency of Estrogen Analogs

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 1 Year: 2011 Page: 996-1003
Author(s): Ria Pal, Md Ataul Islam, Tabassum Hossain, Achintya Saha

Molecular Modeling Used to Evaluate CYP2C9-Dependent Metabolism: Homology Modeling, Molecular Dynamics and Docking Simulations

Journal: Current Drug Metabolism
Volume: 12 Issue: 6 Year: 2011 Page: 533-548
Author(s): Jessica E. Mendieta-Wejebe, Jose Correa-Basurto, Erika M. Garcia-Segovia, Gisela Ceballos-Cancino, Martha C. Rosales-Hernandez

Selective Cholinesterase Inhibitors from Buxus sempervirens L. and their Molecular Docking Studies

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 4 Year: 2011 Page: 276-286
Author(s): Ilkay E. Orhan, Mahmud T.H. Khan, Sinem A. Erdem, Murat Kartal, Bilge Sener

Homology Models in Docking and High-Throughput Docking

Journal: Current Topics in Medicinal Chemistry
Volume: 11 Issue: 1 Year: 2011 Page: 1528-1534
Author(s): Claudio N. Cavasotto

Docking and Molecular Dynamics Simulations of Peroxisome Proliferator Activated Receptors Interacting with Pan Agonist Sodelglitazar

Journal: Protein & Peptide Letters
Volume: 18 Issue: 1 Year: 2011 Page: 1021-1027
Author(s): Xu-Yuan Liu, Run-Ling Wang, Wei-Ren Xu, Li-Da Tang, Shu-Qing Wang, Kuo-Chen Chou

Support Vector Machine Based Prediction of P. falciparum Proteasome Inhibitors and Development of Focused Library by Molecular Docking

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 1 Year: 2011 Page: 898-907
Author(s): Sangeetha Subramaniam, Monica Mehrotra, Dinesh Gupta

CoMFA and CoMSIA Analyses of Highly Selective Pipecolic Acid Based TNF-α Converting Enzyme (TACE) Inhibitors Using Docked Conformations for Molecular Alignment

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 5 Year: 2011 Page: 430-439
Author(s): Malkeet Singh Bahia, Sukhvir Chand, Shravan Kumar Gunda, Shwetha Reddy Gade, Saikh Mahmood, Om Silakari

Docking and Molecular Dynamics Study on the Inhibitory Activity of Novel Inhibitors on Epidermal Growth Factor Receptor (EGFR)

Journal: Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2011 Page: 24-31
Author(s): Qing-Hua Liao, Qing-Zhi Gao, Jing Wei, Kuo-Chen Chou

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