Development and Evaluation of an Eco-Friendly Hand Sanitizer Formulation Valorized from Fruit Peels

Table 6

Binding affinity of the phytocompounds against the target receptor of influenza virus.

Sample no.	Ligand	Receptor-ligand complex	Binding affinity (kcal/mol)
1	IMPHY002419	2HTU_IMPHY002419	−7.2
2	IMPHY003982	2HTU_IMPHY003982	−4.8
3	IMPHY003992	2HTU_IMPHY003992	−8.4
4	IMPHY005537	2HTU_IMPHY005537	−7.6
5	IMPHY006864	2HTU_IMPHY006864	−7.8
6	IMPHY006904	2HTU_IMPHY006904	−8.1
7	IMPHY011789	2HTU_IMPHY011789	−4.6
8	IMPHY012021	2HTU_IMPHY012021	−7.8
9	IMPHY012061	2HTU_IMPHY012061	−5.5
10	IMPHY012147	2HTU_IMPHY012147	−5.3
11	IMPHY012175	2HTU_IMPHY012175	−4.9
12	IMPHY014836	2HTU_IMPHY014836	−6.6
13	IMPHY014852	2HTU_IMPHY014852	−5.4
14	IMPHY014923	2HTU_IMPHY014923	−5.1
15	Peramivir	2HTU_peramivir	−5.7

Bold value represents the highest affinity and relative to the standard compound.