Search Result "Molecular docking"


Review Article

Molecular Docking and Drug Discovery in β-Adrenergic Receptors

Journal: Current Medicinal Chemistry
Volume: 24 Issue: 39 Year: 2017 Page: 4340-4359
Author(s): Santiago Vilar,Eduardo Sobarzo-Sanchez,Lourdes Santana,Eugenio Uriarte

Research Article

Green Synthesis and Molecular Docking of Thiazolyl-thiazole Derivatives as Potential Cytotoxic Agents

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 17 Issue: 9 Year: 2017 Page: 805-815
Author(s): Sobhi M. Gomha, Mohamad R. Abdelaziz, Hassan M. Abdel-Aziz, Shaimaa A. Hassan

Research Article

3D-QSAR, Molecular Docking and Molecular Dynamics Studies of 2,4- Diarylaminopyrimidine Analogues (DAAP Analogues) as Potent ALK Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 3 Year: 2017 Page: 270-286
Author(s): Fulong Wu,Qianqian Lv,Zhonghua Wang,Dandan Li,Peng Peng,Yan Yin,Siheng Cui,Fanhong Wu

Research Article

Structural Investigation of Vinca Domain Tubulin Binders by Pharmacophore, Atom based QSAR, Docking and Molecular Dynamics Simulations

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 8 Year: 2017 Page: 682-695
Author(s): Mohd Athar,Mohsin Y. Lone,Vijay M. Khedkar,Ashish Radadiya,Anamik Shah,Prakash C. Jha

Research Article

Synthesis, Molecular Docking and Pharmacological Study of Pyrimidothiadiazinones and its bis-derivatives

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 4 Year: 2017 Page: 434-443
Author(s): Sobhi M. Gomha,Ikhlass M. Abbas,Mohamed A. A. Elneairy,Mahmoud M. Elaasser,Bazada K. A. Mabrouk

Research Article

Molecular Docking and Structure Activity Relationship Studies of NSAIDs. What do they Reveal about IC50?

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 8 Year: 2017 Page: 949-958
Author(s): Chrysoula Mikra,Georgios Rossos,Sotirios K. Hadjikakou,Nikolaos Kourkoumelis

Research Article

Computational Screening of CCR5 Inhibitors as Potential Entry Inhibitor Microbicides Using 3D-QSAR Studies, Docking and Molecular Dynamics Simulation

Journal: Current HIV Research
Volume: 15 Issue: 4 Year: 2017 Page: 234-244
Author(s): Radhika Ramachandran,Muthusankar Aathi,Durairaj D. Ruban,Shanmughavel Piramanyagam

Research Article

Molecular Docking, Synthesis and CNS Activity of Some Novel 1, 4-Benzodiazepine Derivatives

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 6 Year: 2017 Page: 690-698
Author(s): Sunil S. Menghani, Rupesh Chikhale, Amit Pant, Bijo Mathew, Pramod Khedekar

Research Article

QSAR and Molecular Docking Directed Synthesis and Preliminary Evaluation of Novel Non-Nucleoside HCV NS5B Polymerase Inhibitors

Journal: Anti-Infective Agents
Volume: 15 Issue: 1 Year: 2017 Page: 52-56
Author(s): Vaishali M. Patil,Neeraj Masand,Gurukumar K. R,Maksim Chudayeu,Satya Prakash Gupta,Subeer Samanta,Neerja Kaushik-Basu

Research Article

Synthesis, Molecular Docking, in vitro Antiproliferative and Antioxidant Activity of Novel Pyrrolidinyl-Carbazole Derivatives

Journal: Current Organic Synthesis
Volume: 14 Issue: 8 Year: 2017 Page: 1172-1179
Author(s): Padmaja Pannala,Pedavenkatagari Narayana Reddy,Basireddy V. Subba Reddy,Sunil Misra,Koude Dhevendar,Surender Singh Jadav

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