Article List

Editorial (Thematic Issue: Chemo- and Bioinformatics in the Discovery of Antimalarial Drugs and Arthropod Repellents to Counter Vector Borne Diseases (VBDs))
[ Vol. 9 , Issue. 3 ]
Author(s): Ramanathan Natarajan, Apurba K. Bhattacharjee and Yenamandra S. Prabhakar
Pages: 299-299 (1)
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How Computational Studies of Mosquito Repellents Contribute to the Control of Vector Borne Diseases
[ Vol. 9 , Issue. 3 ]
Author(s): Przemyslaw Miszta, Subhash C. Basak, Ramanathan Natarajan and Wieslaw Nowak
Pages: 300-307 (8)
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In Silico Stereo-Electronic Analysis of PMD (p-Menthane-3-8-Diol) and its Derivatives for Pharmacophore Development May Aid Discovery of Novel Insect Repellents
[ Vol. 9 , Issue. 3 ]
Author(s): Apurba K. Bhattacharjee
Pages: 308-316 (9)
Topological and Physicochemical Characteristics of 1,2,3,4-Tetrahydroacridin- 9(10H)-Ones and Their Antimalarial Profiles: A Composite Insight to the Structure-Activity Relation^§
[ Vol. 9 , Issue. 3 ]
Author(s): Brij K. Sharma, Saroj Verma and Yenamandra S. Prabhakar
Pages: 317-335 (19)
Exploration of Important Sites of Antimalarial Endochins for Optimum Structural Modification Using Group-Based QSAR (G-QSAR) Modeling
[ Vol. 9 , Issue. 3 ]
Author(s): Probir Kumar Ojha and Kunal Roy
Pages: 336-349 (14)
QSAR and Pharmacophore Modeling of Natural and Synthetic Antimalarial Prodiginines
[ Vol. 9 , Issue. 3 ]
Author(s): Baljinder Singh, Ram A. Vishwakarma and Sandip B. Bharate
Pages: 350-359 (10)
Molecular Docking and ADME Studies of Natural Compounds of Agarwood Oil for Topical Anti-Inflammatory Activity
[ Vol. 9 , Issue. 3 ]
Author(s): Dharmendra K. Yadav, Vipin Mudgal, Jyoti Agrawal, Anil K. Maurya, Dnyaneshwar U. Bawankule, Chandan S. Chanotiya, Feroz Khan and Sanjog T. Thul
Pages: 360-370 (11)
A Novel Combined Pharmacophore Mapping and Quantitative Structure Selectivity Relationship Analysis for the Development of Potent and Selective Human Aldose Reductase Inhibitors
[ Vol. 9 , Issue. 3 ]
Author(s): Bhawna Vyas, Baldev Singh and Om Silakari
Pages: 371-384 (14)
CoMFA, CoMSIA and HQSAR Studies of Acetylcholinesterase Inhibitors
[ Vol. 9 , Issue. 3 ]
Author(s): Yu-Ren Jiang, Yan-Yan Yang, Yu-Ling Chen and Zhong-Jie Liang
Pages: 385-395 (11)
Accelerating Quantum Chemistry Calculations with Graphical Processing Units - Toward in High-Density (HD) Silico Drug Discovery
[ Vol. 9 , Issue. 3 ]
Author(s): Yohsuke Hagiwara, Kazuki Ohno, Masaya Orita, Ryota Koga, Toshio Endo, Yutaka Akiyama and Masakazu Sekijima
Pages: 396-401 (6)
In Silico Pharmacophore Modeling on Known Pyridinium Oxime Reactivators of Cyclosarin (GF) Inhibited AChE to Aid Discovery of Potential, More Efficacious Novel Non-Oxime Reactivators
[ Vol. 9 , Issue. 3 ]
Author(s): Apurba K. Bhattacharjee, Kamil Musilek and Kamil Kuca
Pages: 402-411 (10)
Metabolite Concentration as a Criterion for Antibacterial Discovery
[ Vol. 9 , Issue. 3 ]
Author(s): Zhong-Yi Wang, Qiang Zhu and Hong-Yu Zhang
Pages: 412-416 (5)
Ligand Based Validated Comparative Chemometric Modeling and Pharmacophore Mapping of Aurone Derivatives as Antimalarial Agents
[ Vol. 9 , Issue. 3 ]
Author(s): Nilanjan Adhikari, Amit Kumar Halder, Chanchal Mondal and Tarun Jha
Pages: 417-432 (16)
3D QSAR Studies on Substituted Benzimidazole Derivatives as Angiotensin II-AT₁ Receptor Antagonist
[ Vol. 9 , Issue. 3 ]
Author(s): Vivek K. Vyas, Manjunath Ghate, Chetan Chintha and Paresh Patel
Pages: 433-445 (13)

Article List

Editorial (Thematic Issue: Chemo- and Bioinformatics in the Discovery of Antimalarial Drugs and Arthropod Repellents to Counter Vector Borne Diseases (VBDs))

How Computational Studies of Mosquito Repellents Contribute to the Control of Vector Borne Diseases

In Silico Stereo-Electronic Analysis of PMD (p-Menthane-3-8-Diol) and its Derivatives for Pharmacophore Development May Aid Discovery of Novel Insect Repellents

Topological and Physicochemical Characteristics of 1,2,3,4-Tetrahydroacridin- 9(10H)-Ones and Their Antimalarial Profiles: A Composite Insight to the Structure-Activity Relation§

Exploration of Important Sites of Antimalarial Endochins for Optimum Structural Modification Using Group-Based QSAR (G-QSAR) Modeling

QSAR and Pharmacophore Modeling of Natural and Synthetic Antimalarial Prodiginines

Molecular Docking and ADME Studies of Natural Compounds of Agarwood Oil for Topical Anti-Inflammatory Activity

A Novel Combined Pharmacophore Mapping and Quantitative Structure Selectivity Relationship Analysis for the Development of Potent and Selective Human Aldose Reductase Inhibitors

CoMFA, CoMSIA and HQSAR Studies of Acetylcholinesterase Inhibitors

Accelerating Quantum Chemistry Calculations with Graphical Processing Units - Toward in High-Density (HD) Silico Drug Discovery

In Silico Pharmacophore Modeling on Known Pyridinium Oxime Reactivators of Cyclosarin (GF) Inhibited AChE to Aid Discovery of Potential, More Efficacious Novel Non-Oxime Reactivators

Metabolite Concentration as a Criterion for Antibacterial Discovery

Ligand Based Validated Comparative Chemometric Modeling and Pharmacophore Mapping of Aurone Derivatives as Antimalarial Agents

3D QSAR Studies on Substituted Benzimidazole Derivatives as Angiotensin II-AT1 Receptor Antagonist

Topological and Physicochemical Characteristics of 1,2,3,4-Tetrahydroacridin- 9(10H)-Ones and Their Antimalarial Profiles: A Composite Insight to the Structure-Activity Relation^§

3D QSAR Studies on Substituted Benzimidazole Derivatives as Angiotensin II-AT₁ Receptor Antagonist