Search Result "docking"


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
Research Article

A Mechanistic Study of the Antibacterial Activity of Phytoconstituents ofPyracantha crenulata by Using Molecular Docking Studies

Journal: Current Chinese Chemistry
Volume: 2 Issue: 3 Year: 2022 Page: 20-39
Author(s): Ankit Kumar Singh

Review Article

Virtual Screening and Molecular Docking: Discovering Novel c-KITInhibitors

Journal: Current Medicinal Chemistry
Volume: 29 Issue: 2 Year: 2022 Page: 166-188
Author(s): Hamilton Mitsugu Ishiki,Luciana Scotti,Marcus T. Scotti,João Luiz Sobral de Medeiros,Edson Mareco Assunção,Angela Cristina Gomes,Fernanda Mello Tavares

Research Article

Molecular Docking and Pharmacokinetic Studies of Aquillochin and Grewin as SARS-CoV-2 Mpro Inhibitors

Journal: Drug Delivery Letters
Volume: 12 Issue: 1 Year: 2022 Page: 54-61
Author(s):

Research Article

Synthesis, Biological Evaluation, and Docking Analysis of Novel TetrahydrobenzothiopheneDerivatives

Journal: Letters in Drug Design & Discovery
Volume: 19 Issue: 6 Year: 2022 Page: 530-540
Author(s):

Research Article

Some Flavolignans as Potent Sars-Cov-2 Inhibitors via Molecular Docking,Molecular Dynamic Simulations and ADME Analysis

Journal: Current Computer-Aided Drug Design
Volume: 18 Issue: 5 Year: 2022 Page: 337-346
Author(s):

Research Article

Synthesis, Biological Screening and Docking Study of Some Novel Pyrazolopyrano[2,3-B]quinolin Derivatives as Potent Antibacterial Agents

Journal: Current Bioactive Compounds
Volume: 18 Issue: 5 Year: 2022 Page: 58-65
Author(s): Ali Salari Sharif

Research Article

Molecular Docking and Dynamics Simulation Studies of a Dataset of NLRP3 Inflammasome Inhibitors

Journal: Recent Advances in Inflammation & Allergy Drug Discovery
Volume: 16 Issue: 0 Year: 2022 Page: 1-7
Author(s): Igor José dos Santos Nascimento,Thiago Mendonça de Aquino,Edeildo Ferreira da Silva-Júnior

Research Article

Designer Benzodiazepines’ Activity on Opioid Receptors: A Docking Study

Journal: Current Pharmaceutical Design
Volume: 28 Issue: 32 Year: 2022 Page: 2639-2652
Author(s): John Martin Corkery

Research Article

Synthesis, Characterisation and Docking Studies of ThioxoquinolineDerivatives as Potential Anti-Alzheimer Agents

Journal: Current Drug Discovery Technologies
Volume: 19 Issue: 6 Year: 2022 Page: 12-22
Author(s): Shalaka P. Naik,Mamle Desai Shivlingarao

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