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Current Computer-Aided Drug Design

Volume 16, 6 Issues, 2020
ISSN: 1875-6697 (Online)
ISSN: 1573-4099 (Print)
This journal supports open access

In the current pandemic scenario, publication process of all articles related to Coronavirus will be expedited, for timely publication of much needed research

Contents

Current Computer-Aided Drug Design, Volume 16 - Number 4

Editorial   Open Access


Review Article

Computational Drug Repurposing: Classification of the Research Opportunities and Challenges

, 16(4): 354 - 364

Seyedeh Shaghayegh Sadeghi and Mohammad Reza Keyvanpour*


DOI: 10.2174/1573409915666190613113822



Research Article

Prospects of Wedelolactone as a Chemotherapeutic Agent in Gynecological Cancers; Clue From its In Vitro and In Silico Investigation

, 16(4): 365 - 375

Sadia Sarwar*, Tauqeer Amed, Neelum Gul Qazi, Jun Qing Yu and Fazlul Huq


DOI: 10.2174/1573409915666191015113134



Research Article

Computational Prospecting for the Pharmacological Mechanism of Activity: HIV-1 Inhibition by Ixoratannin A-2

, 16(4): 376 - 388

Olujide O. Olubiyi*, Thomas O. Idowu, Abiodun O. Ogundaini and Goodness Orhuah


DOI: 10.2174/1573409915666190702111023



Research Article

The Research of New Inhibitors of Bacterial Methionine Aminopeptidase by Structure Based Virtual Screening Approach of ZINC DATABASE and In Vitro Validation

, 16(4): 389 - 401

Hanane Boucherit*, Abdelouahab Chikhi, Abderrahmane Bensegueni, Amina Merzoug and Jean-Michel Bolla


DOI: 10.2174/1573409915666190617165643



Research Article

Design and Molecular Docking Studies of Some 2,3 Di-Substituted Quinazolin-4-One Analogues Against Staphylococcus aureus UDG

, 16(4): 402 - 406

Amrute B. Bhavesh*, Amrutkar D. Rakesh and Tambe R. Santosh


DOI: 10.2174/1573409915666190916100437



Research Article

A Drug Decision Support System for Developing a Successful Drug Candidate Using Machine Learning Techniques

, 16(4): 407 - 419

Aytun Onay* and Melih Onay


DOI: 10.2174/1573409915666190716143601



Research Article

Identification of Novel Phyto-chemicals from Ocimum basilicum for the Treatment of Parkinson’s Disease using In Silico Approach

, 16(4): 420 - 434

Nageen Mubashir, Rida Fatima and Sadaf Naeem*


DOI: 10.2174/1573409915666190503113617



Research Article

In Silico Screening for Anti-inflammatory Bioactive Molecules from Ayurvedic Decoction, Balaguluchyadi kashayam

, 16(4): 435 - 450

Rahitha Devi S. J. and Prakash Kumar B.*


DOI: 10.2174/1573409915666191015113753



Research Article

Schistosomal Sulfotransferase Interaction with Oxamniquine Involves Hybrid Mechanism of Induced-fit and Conformational Selection

, 16(4): 451 - 459

Fortunatus C. Ezebuo* and Ikemefuna C. Uzochukwu


DOI: 10.2174/1573409915666190708103132



Research Article


Research Article

In Silico Docking of Vitamin E Isomers on Transport Proteins

, 16(4): 467 - 472

Nurul Syeefa Zulkiflee, Siti Amilia Awang, Woo Xian Ming, Muhammad Fauzan Wira’i Kamilan, M Yuveneshwari Mariappan and Tan Jen Kit*


DOI: 10.2174/1573409915666190614113733



Research Article

Combined QSAR Model and Chemical Similarity Search for Novel HMGCoA Reductase Inhibitors for Coronary Heart Disease

, 16(4): 473 - 485

David Mary Rajathei*, Subbiah Parthasarathy and Samuel Selvaraj


DOI: 10.2174/1573409915666190904114247



Research Article

Synthesis, Antitumor Activity, Molecular Docking and DFT Study of Novel Pyrimidiopyrazole Derivatives

, 16(4): 486 - 499

Asmaa M. Fahim*, Mohamed S. Elshikh and Noura M. Darwish


DOI: 10.2174/1573409915666190710094425




Editor-in-Chief

Subhash C. Basak
University of Minnesota Duluth
Duluth, MN
(USA)
Biography
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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