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Current Computer-Aided Drug Design

Volume 17, 7 Issues, 2021
ISSN: 1875-6697 (Online)
ISSN: 1573-4099 (Print)
This journal supports open access


Current Computer-Aided Drug Design, Volume 13 - Number 1

Research Article

Screening of Potential Lead Molecule as Novel MurE Inhibitor: Virtual Screening, Molecular Dynamics and In Vitro Studies

, 13(1): 8 - 21

Kunal Zaveri and Patnala Kiranmayi

DOI: 10.2174/1573409912666161010142943

Research Article

Understanding the Action of Indolizines as Biologically Active Moieties: A Molecular Dynamics Study

, 13(1): 22 - 29

Beata Szefler, Przemyslaw Czelen and Mircea V. Diudea

DOI: 10.2174/1573409912666161004160827

Research Article

Rational Design and Engineering of a Mutant Variant of Urate Oxidase as a Therapeutic Enzyme: A Molecular Dynamics Simulation Approach

, 13(1): 30 - 38

Sajjad Ahrari, Fatemeh Dabbagh, Sobhan Ahrari, Younes Ghasemi, Navid Mogharrab and Yasser Riazalhosseini

DOI: 10.2174/1573409912666160906093025

Research Article

Computational Analysis of Physicochemical Factors Driving CYP2D6 Ligand Interaction

, 13(1): 39 - 47

Olujide O. Olubiyi, Maryam O. Olagunju and Abiola O. Obisesan

DOI: 10.2174/1573409912666160909092600

Research Article

Research Article

A New Computational Approach to the Classification of Fluoroquinolones According to the Biopharmaceutical Classification System

, 13(1): 60 - 74

Klosinska-Szmurlo Ewa, Mazurek A. Pawel, Grudzien Monika and Betlejewska-Kielak Katarzyna

DOI: 10.2174/1573409912666161018094621

Research Article

Predicting Isoform-specific Binding Selectivities of Benzensulfonamides Using QSAR and 3D-QSAR

, 13(1): 75 - 83

Vytautas Ra skevi cius and Visvaldas Kairys

DOI: 10.2174/1573409912666161129153820


Subhash C. Basak
Department of Chemistry & Biochemistry
Center for Water and the Environment, Natural Resources Research Institute
University of Minnesota Duluth
Duluth, MN
View Full Editorial Board

Journal History

Current Computer-Aided Drug Design was introduced in 2005 and Dr. Subhash C. Basak is acting as an Editor-in-Chief since 2012.

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