Current Computer-Aided Drug Design


Subhash C. Basak
University of Minnesota Duluth
Duluth, MN

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Editorial (Thematic Issues: Topological and Electrotopological Descriptors of Molecules: Fundamental Principles and Applications to Computer-Aided Molecular Design - III) promotion: free to download

Volume:9   Issue: 4
Pp: 447-448
Subhash C. Basak and Guillermo Restrepo
DOI: 10.2174/15734099113096660044

Adapting Interrelated Two-Way Clustering Method for Quantitative Structure-Activity Relationship (QSAR) Modeling of Mutagenicity/Non- Mutagenicity of a Diverse Set of Chemicals promotion: free to download

Volume:9   Issue: 4
Pp: 463-471
Subhabrata Majumdar, Subhash C. Basak and Gregory D. Grunwald
DOI: 10.2174/15734099113096660045

Graph Theory Concepts in the Rationales of Anti HIV-1 Compounds

Volume:9   Issue: 4
Pp: 472-481
Utsab Debnath, Seturam B. Katti and Yenamandra S. Prabhakar
DOI: 10.2174/15734099113096660047

Lemont B. Kier: A Bibliometric Exploration of his Scientific Production and its Use

Volume:9   Issue: 4
Pp: 491-505
Guillermo Restrepo, Eugenio J. Llanos and Adriana E. Silva
DOI: 10.2174/15734099113096660043

Editorial (Applications of Docking and Molecular Dynamics in Drug Design) promotion: free to download

Volume:9   Issue: 4
Pp: 506-506
Gang Yang and Zhiwei Yang
DOI: 10.2174/157340990904131213160459

Applications of Docking and Molecular Dynamic Studies on the Search for New Drugs Against the Biological Warfare Agents Bacillus anthracis and Yersinia pestis

Volume:9   Issue: 4
Pp: 507-517
Tanos Celmar Costa França, Ana Paula Guimarães, Wilian Augusto Cortopassi, Aline Alves Oliveira and Teodorico Castro Ramalho
DOI: 10.2174/15734099113099990033

Recent Advances in Protein−Ligand Interactions: Molecular Dynamics Simulations and Binding Free Energy

Volume:9   Issue: 4
Pp: 518-531
Kshatresh Dutta Dubey, Rakesh Kumar Tiwari and Rajendra Prasad Ojha
DOI: 10.2174/15734099113096660036

Drug Design Benefits from Molecular Dynamics: Some Examples

Volume:9   Issue: 4
Pp: 532-546
Ji-Long Zhang, Qing-Chuan Zheng, Wen-Ting Chu and Hong-Xing Zhang
DOI: 10.2174/15734099113099990024

Exploring the Molecular Mechanism of Action Between Drug and RNA Polymerase Based on Partially-Resolved Spatial Structures

Volume:9   Issue: 4
Pp: 547-555
Yajun Sheng, Chen Zhang, Xingye Qiu, Wei Zheng, Jishou Ruan and Yiming Shao
DOI: 10.2174/15734099113099990025

A Review of Monoamine Transporter-Ligand Interactions

Volume:9   Issue: 4
Pp: 556-568
Kalyan Immadisetty and Jeffry D. Madura
DOI: 10.2174/15734099113096660039

Acknowledgments to the Reviewers promotion: free to download

Volume:9   Issue: 4
Pp: 569-569

DOI: 10.2174/157340990904131213162928