Search Result "in silico molecular docking."


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

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

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

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

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

In Silico Methods to Assist Drug Developers in Acetylcholinesterase Inhibitor Design

Journal: Current Medicinal Chemistry
Volume: 18 Issue: 8 Year: 2011 Page: 1122-1136
Author(s): J. A. Bermudez-Lugo, M. C. Rosales-Hernandez, O. Deeb, J. Trujillo-Ferrara, J. Correa-Basurto

In Silico Identification of Small Molecule Mimetics of the Pro-Apoptotic BH3-Helix

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 4 Year: 2011 Page: 355-362
Author(s): Melanie Fullbeck, Julia Hossbach, Ines S. Jaeger, Peter T. Daniel, Robert Preissner

In Silico Prediction of Cytochrome P450-Mediated Drug Metabolism

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 5 Year: 2011 Page: 388-395
Author(s): Tao Zhang, Qi Chen, Li Li, Limin Angela Liu, Dong-Qing Wei

In silico Designing and Screening of Lead Compounds to NS5-Methyltransferase of Dengue Viruses

Journal: Medicinal Chemistry
Volume: 7 Issue: 6 Year: 2011 Page: 655-662
Author(s): Dakshinamurthy Sivakumar, Thirunavukkarasu Sivaraman

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

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