1.4. CHARMM/iAPBS Module

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.

Note

The current version of the CHARMM/APBS module supports serial execution only. Parallel capability will be added in later versions.