plugins/vmd/include/molfile_plugin.h
XXX found Open
Open
int totalcharge; /**< total charge of system. XXX: can be fractional in some- Exclude checks
XXX found Open
Open
* XXX this should really be put into a separate block of- Exclude checks
XXX found Open
Open
char geometry[MOLFILE_BUFSIZ]; /**< type of provided geometry, XXX: remove?- Exclude checks
XXX found Open
Open
int num_electrons; /**< number of electrons. XXX: can be fractional in some- Exclude checks
XXX found Open
Open
* XXX this function will be augmented and possibly superseded by a- Exclude checks
HACK found Open
Open
/* HACK to support generic trajectory information */- Exclude checks