Table 4.

Results of the calculations and molecular coupling of molecules identified from the ME of Chiococca alba.

Binding	Compounds	Affinity Energy (kcal/mol)
14	Rutin	−8.1
12	Oleyl alcohol, trifluoroacetate	−7.4
11	3,5-Dimethoxycinnamic acid	−7
15	Morin	−7
8	(E)-4-Methoxycinnamic acid	−6.9
9	Coniferol	−6.8
10	Tetradecanoic acid	−6.5
6	3-nitrobenzyl iodide	−6.4
13	Palmitic Acid	−6.4
2	2-phenylpropanal	−6.1
3	1- (2-Hydroxyphenyl) ethanone	−6
4	2-isopropoxyphenol	−5.9
5	2,6-dimethoxyphenol	−5.7
7	1,6-Anhydro-beta-D-glucopyranose	−5.2
1	1-Deoxy-2,4-O-methylene-D-xylitol	−5