Search Result "molecular modelling data"


Review Article

Research Advances in Molecular Modeling in Cyclodextrins

Journal: Current Pharmaceutical Design
Volume: 23 Issue: 3 Year: 2017 Page: 522-531
Author(s): Qianqian Zhao,Weixiang Zhang,Runmiao Wang,Yitao Wang,Defang Ouyang

Research Article

Molecular Modeling Investigation of Some New 2-mercaptoimidazoles

Journal: Current Computer-Aided Drug Design
Volume: 13 Issue: 1 Year: 2017 Page: 48-56
Author(s): Nidhi Rani, Randhir Singh

Theoretical Models for Biopolymers

Ebook: Advances in Physicochemical Properties of Biopolymers (Part 1)

Volume: 1 Year: 2017
Author(s): J. Ginés Hernández Cifre,F. Guillermo Díaz Baños
Doi: 10.2174/9781681084534117010019

NMDA Receptor as a Molecular Target for Central Nervous System Disorders: The Advances and Contributions of Molecular Modeling

Ebook: Frontiers in Clinical Drug Research - CNS and Neurological Disorders

Volume: 5 Year: 2017
Author(s): Marcos Vinicius Santana,Helena Carla Castro,Paula Alvarez Abreu
Doi: 10.2174/9781681085852117050008
Research Article

Computational Studies of N-substituted Quinolinonyl Diketo Acid Derivatives as HIV Integrase Strand Transfer Inhibitors using 3D-QSAR, Pharmacophore Modeling and Molecular Docking

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 11 Year: 2017 Page: 1291-1302
Author(s): Yuming Luo,Yujie Ren,Xiaodong Gao

Review Article

Polypeptide-matrix Synthesis and Quantum-chemical Models of Molecular Structures of 3d-metal Macro Heterocyclic Compounds

Journal: Current Organic Chemistry
Volume: 21 Issue: 21 Year: 2017 Page: 2135-2156
Author(s): Oleg V. Mikhailov

Research Article

Molecular Modeling and Dynamics Simulation Analysis of KATNAL1 for Identification of Novel Inhibitor of Sperm Maturation

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 1 Year: 2017 Page: 82-92
Author(s): Kishore Sarma,Shubhadeep Roychoudhury,Sudipta Sankar Bora,Budheswar Dehury,Pratap Parida,Saurav Das,Robin Das,Chandrajit Dohutia,Sangeeta Nath,Bibhas Deb,Mahendra K Modi

Review Article

A Practical Guide to Molecular Docking and Homology Modelling for Medicinal Chemists

Journal: Current Topics in Medicinal Chemistry
Volume: 17 Issue: 1 Year: 2017 Page: 2023-2040
Author(s): Anna E. Lohning, Stephan M. Levonis, Billy Williams-Noonan, Stephanie S. Schweiker

Research Article

Protein Modeling and Molecular Dynamics Simulation of Cloned Regucalcin (RGN) Gene from Bubalus bubalis

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 3 Year: 2017 Page: 186-192
Author(s): Harikrishna Pillai,Brijesh Singh Yadav,Navaneet Chaturvedi,Arif Tasleem Jan,Girish Kumar Gupta,Mohammad Hassan Baig,Sanjeev Kumar Bhure

Review Article

Advanced In Silico Approaches for Drug Discovery: Mining Information from Multiple Biological and Chemical Data Through mtk- QSBER and pt-QSPR Strategies

Journal: Current Medicinal Chemistry
Volume: 24 Issue: 16 Year: 2017 Page: 1687-1704
Author(s): Alejandro Speck-Planche,Maria Natália Dias Soeiro Cordeiro

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