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Contents

Current Computer-Aided Drug Design, Volume 9 - Number 1




Cycloxygenase-2 (COX-2) - A Potential Target for Screening of Small Molecules as Radiation Countermeasure Agents: An In Silico Study

, 9(1): 35 - 45

Jayadev Joshi, Tapan K. Barik, Nitisha Shrivastava, Manali Dimri, Subhajit Ghosh, Rahul S. Mandal, Srinivasan Ramachandran and Indracanti P. Kumar


DOI: 10.2174/1573409911309010004


Efficacy Prediction of Jamu Formulations by PLS Modeling

, 9(1): 46 - 59

Farit M. Afendi, Latifah K. Darusman, Aki Hirai Morita, Md. Altaf-Ul-Amin, Hiroki Takahashi, Kensuke Nakamura, Ken Tanaka and Shigehiko Kanaya


DOI: 10.2174/1573409911309010005



Computational Modeling of Environmentally Responsive Hydrogels (ERH) for Drug Delivery System

, 9(1): 76 - 82

P.K. Krishnan Namboori, U.P. Ranjini, Asha A. Manakadan, Anila Jose, K.S. Silvipriya, N. Belzik and O.M. Deepak


DOI: 10.2174/1573409911309010007




Biomedical Data Integration in Computational Drug Design and Bioinformatics

, 9(1): 108 - 117

Jose A. Seoane, Vanessa Aguiar-Pulido, Cristian R. Munteanu, Daniel Rivero, Juan R. Rabunal, Julian Dorado and Alejandro Pazos


DOI: 10.2174/15734099112089990011


Quantum Mechanical Scoring: Structural and Energetic Insights into Cyclin-Dependent Kinase 2 Inhibition by Pyrazolo[1,5-a]pyrimidines

, 9(1): 118 - 129

Pathik S. Brahmkshatriya, Petr Dobes, Jindrich Fanfrlik, Jan Rezac, Kamil Paruch, Agnieszka Bronowska, Martin Lepsík and Pavel Hobza


DOI: 10.2174/1573409911309010011





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