SARS-CoV2 Main Protease/Ritonavir MD simulations trajectories

https://zenodo.org/record/3746892#.Xo-ewFMzbcM

SARS-CoV2 Main Protease/Lopinavir MD simulations trajectories

https://zenodo.org/record/3751321#.XpXIH1MzZmM

All Atom Molecular Dynamics Simulations of inhibitor N3 at the binding pocket of SARS-CoV2 Main Protease (PDB ID: 6LU7)

https://zenodo.org/record/3756976



All-atom 500-nano seconds Molecular Dynamics Simulations of SARS-CoV-2 Spike Receptor-binding Domain bound with ACE2

https://zenodo.org/record/3822299

TOP-100 DOCKING POSES OF FDA APPROVED AND DRUGS IN CLINICAL INVESTIGATION AT SARS-CoV2 SPIKE/ACE2 INTERFACE

https://zenodo.org/record/3825310

TOP-100 DOCKING POSES OF FDA APPROVED DRUGS AND DRUGS IN CLINICAL INVESTIGATION AT SARS-CoV2 MAIN PROTEASE

https://zenodo.org/record/3825509#.XrxIXBMzZmM