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Brainware University Digital Repository
Browsing by Subject Molecular dynamics
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Showing results 1 to 3 of 3
Issue Date
Title
Author(s)
2026-06-05
Computational thermodynamics of Apilanthol as a COX-2 inhibitor: Docking dynamics, and binding energy analysis
Arun Kumar Patel
2026-06-12
In silico optimization of pyrimidine thiazolidinedione hybrids targeting PPAR-ʏ: Design, docking, MM-GBSA, ADMET, ADMET, and MD simulation
Rituparna Palit
2026-05-23
Modelling DNA ligand interaction through varible force field based MD simulations
Anwesh Pandey
