EXCLUDE_VDW_LIST

Speficy bonds (via atom kinds) for fine tuning of 1-2 exclusion lists. If this section is not present the 1-2 exclusion is applied to all bond kinds. When this section is present the 1-2 exclusion is applied ONLY to the bonds defined herein. This section allows ONLY fine tuning of 1-2 interactions. [Edit on GitHub]

Keywords

BOND

Keyword descriptions

BOND: string[2]

Usage: BOND {KIND1} {KIND2}

Specify the atom kinds involved in the bond for which 1-2 exclusion holds. [Edit on GitHub]