chem_score.tbl

This file contains the interaction matrix for how an chemical interaction score between chemical labels is scaled.

For an explanation of the definition field, see Atom definition rules on page 104 .

Table 12. Example of chem_score.tbl

label null

label hydrophobic

label donor

label acceptor

label polar

 

table

0

0 1

0 -1 -1

0 -1 1 -1

0 -1 1 1 1

 

 

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