Contents

Current Pharmaceutical Design, Volume 18 - Number 9

Editorial [Hot Topic: In Silico Lead Identification and Optimization for Drug Discovery (Executive Guest Editor: Shuxing Zhang)]

, 18(9): 1171 - 1172

Shuxing Zhang


DOI: 10.2174/138161212799436403




Computational Insights for the Discovery of Non-ATP Competitive Inhibitors of MAP Kinases

, 18(9): 1173 - 1185

Michael J. Schnieders, Tamer S. Kaoud, Chunli Yan, Kevin N. Dalby and Pengyu Ren


DOI: 10.2174/138161212799436368




Cis-enone Resorcylic Acid Lactones (RALs) as Irreversible Protein Kinase Inhibitors

, 18(9): 1186 - 1198

Linyi Wei, Jiuhong Wu, Guanqun Li and Ning Shi


DOI: 10.2174/138161212799436395




Identification of HIV Inhibitors Guided by Free Energy Perturbation Calculations

, 18(9): 1199 - 1216

Orlando Acevedo, Zandrea Ambrose, Patrick T. Flaherty, Hadega Aamer, Prashi Jain and Somisetti V. Sambasivarao


DOI: 10.2174/138161212799436421




From Laptop to Benchtop to Bedside: Structure-based Drug Design on Protein Targets

, 18(9): 1217 - 1239

Lu Chen, John K. Morrow, Hoang T. Tran, Sharangdhar S. Phatak, Lei Du-Cuny and Shuxing Zhang


DOI: 10.2174/138161212799436386




Computational Drug Design Targeting Protein-Protein Interactions

, 18(9): 1240 - 1254

Rachelle J. Bienstock


DOI: 10.2174/138161212799436449




Computational Prediction of Protein Hot Spot Residues

, 18(9): 1255 - 1265

John Kenneth Morrow and Shuxing Zhang


DOI: 10.2174/138161212799436412




The Challenges Involved in Modeling Toxicity Data In Silico: A Review

, 18(9): 1266 - 1291

M. Paul Gleeson, Sandeep Modi, Andreas Bender, Richard L. Marchese Robinson, Johannes Kirchmair, Malinee Promkatkaew, Supa Hannongbua and Robert C. Glen


DOI: 10.2174/138161212799436359




Multi-Parameter Optimization: Identifying High Quality Compounds with a Balance of Properties

, 18(9): 1292 - 1310

Matthew D. Segall


DOI: 10.2174/138161212799436430




The Different Ways through Which Specificity Works in Orthosteric and Allosteric Drugs

, 18(9): 1311 - 1316

Ruth Nussinov and Chung-Jung Tsai


DOI: 10.2174/138161212799436377




Webmaster Contact: info@benthamscience.org
Copyright © 2018 Bentham Science