chem_match.tbl
This file contains the interaction matrix for which chemical labels can form an interaction in matching.
-
The labels must be identical to labels in
chem.defn
.
-
The table flag indicates the beginning of the interaction table.
-
Compatible labels are identified with a one, otherwise a zero.
For an explanation of the definition field, see
Atom definition rules on page 104
.
Table 11. Example of chem_match.tbl
label null
label hydrophobic
label donor
label acceptor
label polar
table
1
1 1
1 0 1
1 0 0 1
1 0 1 1 1
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