imat¶
Todo
This command has not yet been ported to the new APBS syntax (see YAML- and JSON-format input files).
This keyword can be used to load in the surface integral matrices previously generated by PB-SAM named as molmsphs.bin
for molecule ID s and coarse-grained sphere s (see pbam-auto for more information).
The syntax is:
imat {prefix}
where prefix
is the filename prefix molmsph
.
The s.bin
will be appended during the program run.
Todo
It would be better to generalize the READ input file section section of the input file rather than use the imat
command.
This command also needs to be cleaned up – it’s too fragile.
Documented in https://github.com/Electrostatics/apbs/issues/495