The CHARMM/APBS interface makes most of the APBS functionality available to CHARMM users. The interface was designed as an extension to the CHARMM's PBEQ module. The CHARMM/APBS module is invoked by APBS keyword inside of the PBEQ section. The module's keywords are identical or similar to APBS keywords to allow for easy transition between the codes.
![]() | The current version of the CHARMM/APBS module supports serial execution only. Parallel capability will be added in later versions. |