Contents

Current Computer-Aided Drug Design, Volume 12 - Number 2

Meet Our Editorial Board Member

, 12(2): 83

Asim K. Debnath


DOI: 10.2174/157340991202160713190134




EDITORIAL: Chemodescriptor Based QSARs of Structurally Homogeneous Versus Heterogeneous Chemical Data Sets: Some Comments on the Congenericity Principle vis-à-vis Diversity Begets Diversity Principle

, 12(2): 84 - 86

Subhash C. Basak and Subhabrata Majumdar


DOI: 10.2174/157340991202160713190446




Characterizing the Zika Virus Genome – A Bioinformatics Study

, 12(2): 87 - 97

Ashesh Nandy, Sumanta Dey, Subhash C. Basak, Dorota Bielinska-Waz and Piotr Waz


DOI: 10.2174/1573409912666160401115812





Clarification of Interaction Mechanism of Mouse Hepatitis Virus (MHV) N and nsp3 Protein with Homology Modeling and Protein-Protein Docking Analysis

, 12(2): 98 - 106

Gizem Tatar and Tugba Taskin Tok


DOI: 10.2174/1573409912666160226131253





Molecular Dynamics Simulation Reveal the Mechanism of Resistance of Mutant Actins to Latrunculin A – Insight into Specific Modifications to Design Novel Drugs to Overcome Resistance

, 12(2): 107 - 118

Roopa Lalitha, Pravin Kumar R. and M. M. Sudheer Mohammed


DOI: 10.2174/157340991202160713193245





Rhodomyrtone Target Exploration: Computer Aided Search on Staphylococcus aureus Key Proteins as a Potential Therapeutic Target

, 12(2): 119 - 134

Dennapa Saeloh, Varomyalin Tipmanee and Supayang P. Voravuthikunchai


DOI: 10.2174/1573409912666160505112940





Discovery of Novel HIV-1 Integrase Inhibitors Using QSAR-Based Virtual Screening of the NCI Open Database

, 12(2): 135 - 153

Gene M. Ko, Rajni Garg, Barbara A. Bailey and Sunil Kumar


DOI: 10.2174/1573409912666160414104902





Design of Broad-Spectrum Inhibitors of Influenza A Virus M2 Proton Channels: A Molecular Modeling Approach

, 12(2): 154 - 164

Yuri N. Klimochkin, Vadim A. Shiryaev, Pavel V. Petrov, Eugene V. Radchenko, Vladimir A. Palyulin and Nikolay S. Zefirov


DOI: 10.2174/1573409912666160505113408





Current Status of Computer-Aided Drug Design for Type 2 Diabetes

, 12(2): 167 - 177

Shabana Bibi and Katsumi Sakata


DOI: 10.2174/1573409912666160426120709





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