Molecular dynamics and absolute binding free energy studies of piperine derivatives as potential inhibitors of SARS-CoV-2 main protease
Author:
Affiliation:
1. Department of Organic Chemistry, Gayatri Vidya Parishad College for Degree and PG Courses (Autonomous), Visakhapatnam, Andhra Pradesh, India
2. Department of Chemistry, SRM University-AP, Mangalagiri, Andhra Pradesh, India
Publisher
Informa UK Limited
Subject
Molecular Biology,General Medicine,Structural Biology
Link
https://www.tandfonline.com/doi/pdf/10.1080/07391102.2023.2193987
Reference35 articles.
1. Absolute Alchemical Free Energy Calculations for Ligand Binding: A Beginner’s Guide
2. Design, synthesis and biological evaluation of piperic acid triazolyl derivatives as potent anti-inflammatory agents
3. Synthesis and in vitro and in silico antimicrobial studies of novel piperine–pyridine analogs
4. Synthesis, in vitro and in silico Anti-Proliferative Studies of Novel Piperiene-Oxadiazole and Thiadiazole Analogs
5. In vitro TRPV1 activity of piperine derived amides
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