In Silico Screening, Alanine Mutation, and DFT Approaches for Identification of NS2B/NS3 Protease Inhibitors

Table 2

Induced Fit Docking results.

Sl. number	Ligand	Energy
1	Ligand7	−49.17
2	Ligand8	−62.71
3	Ligand19  (pose 1)	−47.00
4	Ligand19  (pose 2)	−64.16