BiologicalMolecules
f
k
-
f
k
2
Ala
Asp
Cys
Phe
Hys
Adenosine
Cytosine
D-Glucose
Saccharose
Palmitic Acid
PalmitoleicAcid
N1
N1
S9
N1
C12
N19
O24
O16
O43
O3
C11
N1
N1
S9
N1
C12
N19
O24
O12
O43
C12
C11
Table 1:
Electrophilic attack site and dual descriptor in biological molecules obtained with B3LYP/6-31G(d).