Search Result "molecular docking"


Molecular Docking Studies

Ebook: Quick Guideline for Computational Drug Design

Volume: 1 Year: 2018
Author(s): Sheikh Arslan Sehgal,Rana Adnan Tahir,A. Hammad Mirza,Asif Mir
Doi: 10.2174/97816810860331180101
Review Article

Parallelization of Molecular Docking: A Review

Journal: Current Topics in Medicinal Chemistry
Volume: 18 Issue: 1 Year: 2018 Page: 1015-1028
Author(s): Dong Dong,Zhijian Xu,Zhong Wu,Shaoliang Peng

Research Article

Molecular Docking for Prediction and Interpretation of Adverse Drug Reactions

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 21 Issue: 5 Year: 2018 Page: 314-322
Author(s): Heng Luo,Achille Fokoue-Nkoutche,Nalini Singh,Lun Yang,Jianying Hu,Ping Zhang

Review Article

Advancements in Docking and Molecular Dynamics Simulations Towards Ligand-receptor Interactions and Structure-function Relationships

Journal: Current Topics in Medicinal Chemistry
Volume: 18 Issue: 2 Year: 2018 Page: 1755-1768
Author(s): Ahmad Abu Turab Naqvi,Taj Mohammad,Gulam Mustafa Hasan,Md. Imtaiyaz Hassan

Research Article

Homology Modeling and Molecular Docking Studies of Bacillomycin and Iturin Synthetases with Novel Ligands for the Production of Therapeutic Lipopeptides

Journal: Current Drug Discovery Technologies
Volume: 15 Issue: 2 Year: 2018 Page: 132-141
Author(s): J. Satya Eswari,Swasti Dhagat,Shubham Kaser,Anoop Tiwari

Research Article

Identification of Human Acetylcholinesterase Inhibitors from the Constituents of EGb761 by Modeling Docking and Molecular Dynamics Simulations

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 21 Issue: 1 Year: 2018 Page: 41-49
Author(s): Lihu Zhang,Dongdong Li,Fuliang Cao,Wei Xiao,Linguo Zhao,Gang Ding,Zhen zhong Wang

Research Article

Molecular Modeling Studies of Urea-morpholinopyrimidine Analogues as Dual Inhibitors of mTORC1 and mTORC2 Using 3D-QSAR, Topomer CoMFA and Molecular Docking Simulations

Journal: Letters in Drug Design & Discovery
Volume: 15 Issue: 1 Year: 2018 Page: 1026-1035
Author(s): Xiaodong Gao,Yujie Ren,Jianqing Huang,Anjian Pan

Research Article

Molecular Docking Studies Applied to a Dataset of Cruzain Inhibitors

Journal: Current Computer-Aided Drug Design
Volume: 14 Issue: 1 Year: 2018 Page: 68-78
Author(s): Edeildo Ferreira da Silva-Junior,Paulo Henrique Barcellos Franca,Frederico Favaro Ribeiro,Francisco Jaime Bezerra Mendonca-Junior,Luciana Scotti,Marcus Tullius Scotti,Thiago Mendonca de Aquino,Joao Xavier de Araujo-Junior

Research Article

Antiallergy Drugs as Potent Inhibitors of Lipase with Structureactivity Relationships and Molecular Docking

Journal: Anti-Inflammatory & Anti-Allergy Agents in Medicinal Chemistry
Volume: 17 Issue: 2 Year: 2018 Page: 95-101
Author(s): Benarous Khedidja,Benguechoua Madjeda,Ghibeche Abderrahmane

Research Article

Molecular Modeling, Docking, Dynamics and Simulation of Gefitinib and its Derivatives with EGFR in Non-small Cell Lung Cancer

Journal: Current Computer-Aided Drug Design
Volume: 14 Issue: 3 Year: 2018 Page: 246-252
Author(s): Pulakuntla Swetha Reddy,Kiran Bharat Lokhande,Shuchi Nagar,Vaddi Damodara Reddy,P. Sushma Murthy,K. Venkateswara Swamy

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