Search Result "Hybrid Docking-MD"


Research Article

Determination of Hybrid TSPO Ligands with Minimal Impact of SNP(rs6971) through Molecular Docking and MD Simulation Study

Journal: Letters in Drug Design & Discovery
Volume: 19 Issue: 6 Year: 2022 Page: 549-563
Author(s): Anupriya Adhikari,Anwesh Pandey,Devesh Kumar,Anjani K. Tiwari

Molecular Hybrids with Anticancer Activity

Ebook: Topics in Anti-Cancer Research
Volume: 4 Year: 2015
Author(s): Samir Mehndiratta,Sahil Sharma,Sunil Kumar,Kunal Nepali
Doi: 10.2174/9781681080765115040008

Role of Ensemble Conformational Sampling Using Molecular Docking & Dynamics in Drug Discovery

Ebook: Frontiers in Computational Chemistry
Volume: 6 Year: 2022
Author(s):
Doi: 10.2174/9789815036848122060004

Tubulin-Targeting Agents in Hybrid Drugs

Journal: Current Medicinal Chemistry
Volume: 17 Issue: 7 Year: 2010 Page: 609-639
Author(s): E. C. Breen, J. J. Walsh

Review Article

Quantum Molecular Dynamics, Topological, Group Theoretical and Graph Theoretical Studies of Protein-Protein Interactions

Journal: Current Topics in Medicinal Chemistry
Volume: 19 Issue: 6 Year: 2019 Page: 426-443
Author(s): Krishnan Balasubramanian,Satya P. Gupta

Mini-Review Article

Hybrid Quantum Mechanics/Molecular Mechanics (QM/MM) Simulation:A Tool for Structure-Based Drug Design and Discovery

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 22 Issue: 8 Year: 2022 Page: 1096-1107
Author(s): Vivek K. Vyas,Prajakta U. Kulkarni

AAV Hybrid Serotypes: Improved Vectors for Gene Delivery

Journal: Current Gene Therapy
Volume: 5 Issue: 3 Year: 2005 Page: 299-310
Author(s): Vivian W. Choi, Douglas M. McCarty, R. Jude Samulski

In Silico Identification of Irreversible Cathepsin B Inhibitors as Anti- Cancer Agents: Virtual Screening, Covalent Docking Analysis and Molecular Dynamics Simulations

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 4 Year: 2015 Page: 399-410
Author(s): Mbatha Sbongile, Mahmoud E.S. Soliman

The Role of Insulin Receptor Isoforms and Hybrid Insulin/IGF-I Receptors in Human Cancer

Journal: Current Pharmaceutical Design
Volume: 13 Issue: 7 Year: 2007 Page: 671-686
Author(s): Antonino Belfiore

Research Article

Designing and In silico Studies of Novel Hybrid of 1,3,4-oxadiazolechalconeDerivatives as EGFR Inhibitors

Journal: Current Drug Discovery Technologies
Volume: 20 Issue: 6 Year: 2023 Page: 47-59
Author(s): Shital M Patil

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