Current Computer-Aided Drug Design


Subhash C. Basak
University of Minnesota Duluth
Duluth, MN

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Beware of External Validation! - A Comparative Study of Several Validation Techniques used in QSAR Modelling

Volume:14   Issue: 4
Pp: 284-291
Subhabrata Majumdar* and Subhash C. Basak
DOI: 10.2174/1573409914666180426144304

Structural Optimization of Mangiferin Binding to Cancer Molecular Targets: A Guide for Synthetic Derivatization

Volume:14   Issue: 4
Pp: 292-301
Bamigboye J. Taiwo*, Olujide O. Olubiyi* and Fanie R. van Heerden
DOI: 10.2174/1573409914666180321110519

Development of QSPR Strategy for the Solubility Prediction

Volume:14   Issue: 4
Pp: 302-309
Nupur S. Munjal, Manu Sharma and Tiratha Raj Singh*
DOI: 10.2174/1573409914666180713114954

2, 5-Disubstituted Phthalimides: Design, Synthesis and Anticonvulsant Activity in scPTZ and MES Models

Volume:14   Issue: 4
Pp: 310-321
Atefeh Saadabadi, Babak Kohen, Maryam Irandoust, Hamed Shafaroodi, Tara Mohammadpour, Mahdi Rezayat and Asghar Davood*
DOI: 10.2174/1573409914666180516115450

N-Substituted Aryl Sulphonamides as Potential Anti-Alzheimer’s Agents: Design, Synthesis and Biological Evaluation

Volume:14   Issue: 4
Pp: 338-348
Neeraj Masand*, Satya P. Gupta and Ratan Lal Khosa
DOI: 10.2174/1573409914666180604115425

Molecular Docking, In-Silico ADMET Study and Development of 1,6- Dihydropyrimidine Derivative as Protein Tyrosine Phosphatase Inhibitor: An Approach to Design and Develop Antidiabetic Agents

Volume:14   Issue: 4
Pp: 349-362
Ashish D. Patel*, Rahul Barot, Inaxi Parmar, Ishan Panchal, Umang Shah, Mehul Patel and Bharat Mishtry
DOI: 10.2174/1573409914666180426125721

Salient Aspects of PBP2A-inhibition; A QSAR Study

Volume:14   Issue: 4
Pp: 363-369
Adewale J. Ogunleye*, Gabriel O. Eniafe, Olumide K. Inyang, Benjamin Adewumi and Olaposi I. Omotuyi
DOI: 10.2174/1573409914666180516114314

4D-QSAR Study of Some Pyrazole Pyridine Carboxylic Acid Derivatives By Electron Conformational-Genetic Algorithm Method

Volume:14   Issue: 4
Pp: 370-384
Burak Tuzun, Sevtap Caglar Yavuz, Nazmiye Sabanci and Emin Saripinar*
DOI: 10.2174/1573409914666180514094202

Polypharmacology Approach Against Migraine with Aura and Brain Edema for the Development of an Efficient Inhibitor and its Analogues

Volume:14   Issue: 4
Pp: 385-390
Samawia Rizwan, Asim Mehmood, Irum Khalid, Muhammad Saad Khan, Qudsia Yousafi, Saima Kalsoom and Hamid Rashid*
DOI: 10.2174/1573409914666180514092618

2D & 3D-QSAR Study on Novel Piperidine and Piperazine Derivatives as Acetylcholinesterase Enzyme Inhibitors

Volume:14   Issue: 4
Pp: 391-397
Maryam Nazari, Sayyed Abbas Tabatabai and Elham Rezaee*
DOI: 10.2174/1573409914666180726092800

Acknowledgements to Reviewers free to download

Volume:14   Issue: 4
Pp: 398-398

DOI: 10.2174/157340991404181004094502