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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
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Ranking and Category

  • 54th of 61 in

    Chemistry, Medicinal

  • 89th of 106 in

    Computer Science, Interdisciplinary Applications

In the current Pandemic scenario, all articles related to Coronavirus will be processed on a free, quick track basis, to ensure timely review and publication of much needed research

Articles Ahead of Print



Dapsone is not a Pharmacodynamic Lead Compound for its Aryl Derivatives


Thomas Scior*, Hassan H. Abdallah, Kenia Salvador- Atonal and Stefan Laufer


DOI: 10.2174/1573409915666191010104527
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Investigation of New Inhibitors of UDP-N-Acetylglucosamine Enolpyruvyl Transferase (MurA) by Virtual Screening with Antibacterial Assessment


Ilham Boulhissa*, Abdelouahab Chikhi, Abderrahmane Bensegueni, Mohammad Ahmad Ghattas, El Hassen Mokrani, Sara Alrawashdeh and Dana Emad Eddin Obaid


DOI: 10.2174/1573409916666200213124929
View Abstract View on PubMed









Proposition of Potential GSK-3β Inhibitors for the Treatment of Alzheimer`s Disease: A Molecular Modeling Study


Leandro L. Castro, Leide C. S. Picanço, Jaderson V. Silva, Lucilene R. Souza, Kessia P. A. Sousa, Abraão A. Pinheiro, Gisele A. Chaves, Hueldem R. C. Teixeira, Guilherme M. Silva, Carlton A. Taft, Carlos Henrique Tomich de Paula da Silva and Lorane Izabel da Silva Hage-Melim*


DOI: 10.2174/1573409915666191015110734
View Abstract



In silico Studies, Synthesis and Antitubercular Activity of Some Novel Quinoline - Azitidinone Derivatives


Trupti. S. Chitre*, Kalyani. D. Asgaonkar, Amrut B. Vikhe, Shital M Patil, Dinesh. R. Garud, Vijay M. Khedkar, Dhiman Sarkar, Laxman U. Nawale and Amar Yeware


DOI: 10.2174/1573409916666200129095952
View Abstract View on PubMed













Petra/Osiris/Molinspiration and Molecular Docking Analyses of 3-Hydroxy-Indolin-2-one Derivatives as Potential Antiviral Agents


Taibi Ben Hadda*, Vesna Rastija*, Faisal AlMalki, Abderrahim Titi, Rachid Touzani, Yahia N. Mabkhot, Shah Khalid, Abdelkader Zarrouk and Bina S. Siddiqui


DOI: 10.2174/1573409916666191226110029
View Abstract View on PubMed







Targeting Peptidyl-prolyl Cis-trans Isomerase NIMA-interacting 1: A Structure-based Virtual Screening Approach to Find Novel Inhibitors


Kauê Santana da Costa*, João Marcos Galúcio, Deivid Almeida de Jesus, Guelber Cardoso Gomes, Anderson Henrique Lima e Lima, Paulo Sérgio Taube, Alberto Monteiro dos Santos and Jerônimo Lameira


DOI: 10.2174/1573409915666191025114009
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Multi-Targeted Design and Development of Dihydroisoquinolines as Potent Antimalarials


Raviraj V. Mule*, Sneha P. Rochlani, Prafulla B. Choudhari, Rakesh P Dhavale and Manish S. Bhatia


DOI: 10.2174/1573409915666191017145833
View Abstract View on PubMed






Synthesis and Anti-mycobacterium Study on Halo-substituted 2-aryl oxyacetohydrazones


Vijay J. Desale, Suraj N. Mali, Hemchandra K. Chaudhari, Maya C. Mali, Bapu R. Thorat* and Ramesh S. Yamgar


DOI: 10.2174/1573409915666191018120611
View Abstract


Interactions of Flavone and Steroid from A. subintegra as Potential Inhibitors for Porcine Pancreatic Lipase


Mastura Ibrahim, Saripah Salbiah Syed Abdul Azziz*, Chee Fah Wong, Yuhanis Mhd Bakri and Fauziah Abdullah


DOI: 10.2174/1573409915666191015112320
View Abstract







Synthesis, SAR, Molecular Docking and Anti-Microbial Study of Substituted N-bromoamido-2-aminobenzothiazoles


Devidas G. Anuse*, Bapu R. Thorat, Sudhir Sawant, Ramesh S. Yamgar*, Hemchandra K. Chaudhari and Suraj N. Mali


DOI: 10.2174/1573409915666190902143648
View Abstract View on PubMed



Inhibition of 2C Coxsackie B Virus Protein to Decrease Pathogenicity of Diabetes Mellitus Type1


Amina Amin, Muhammad Asif Rasheed*, Rana Aamir Diwan, Saddia Bano, Adnan Riaz, Muhammad Nasir Iqbal, Muhammad Wasim Sajid and Muhammad Shahid


DOI: 10.2174/1573409915666190820154422
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In Silico Insights on IL-6: A Potential Target for Multicentric Castleman Disease


Abhishek Aher, Trishang Udhwani, Ravina Khandelwal, Aakanksha Limaye, Tajamul Hussain, Anuraj Nayarisseri* and Sanjeev Kumar Singh


DOI: 10.2174/1573409915666190902142524
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Synthesis, In-Silico and Biological Studies of thiazolyl-2h-chromen-2-one Derivatives as Potent Antitubercular Agents


Bhagwat S. Jadhav, Ramesh S. Yamgar*, Rajesh S. Kenny, Suraj N. Mali, Hemchandra K. Chaudhari and Mustapha C. Mandewale


DOI: 10.2174/1386207322666190722162100
View Abstract








In Silico Docking of Vitamin E Isomers on Transport Proteins


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


DOI: 10.2174/1573409915666190614113733
View Abstract View on PubMed









Virtual Screening for Type ⅡB Inhibitors of B-RafV600E Kinase


Kai-Xiong Qiu, Wen Zhang, Fang Yu, Wei Li, Zhong-Wen Sun, Shu-Qun Zhang, Ya-Juan Chen and Hui-Ding Xie*


DOI: 10.2174/1573409915666190130162821
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3D-QSAR and Molecular Docking Studies on Design Anti-Prostate Cancer Curcumin Analogues


Xi Meng, Lianhua Cui, Fucheng Song, Mingyuan Luan, Junjie Ji, Hongzong Si*, Yunbo Duan and Honglin Zhai


DOI: 10.2174/1573409914666181029123746
View Abstract View on PubMed



In Silico Design of Fusion Toxin DT389GCSF and a Comparative Study


Maryam Ghodrati Siahmazgi, Mohammad Ali Nasiri Khalili*, Fathollah Ahmadpour, Sirus Khodadadi and Mehdi Zeinoddini


DOI: 10.2174/1573409914666181012151242
View Abstract View on PubMed



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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