NAME¶
csg_fmatch - Part of the VOTCA package
SYNOPSIS¶
csg_fmatch [OPTIONS]
csg_fmatch [–help]
DESCRIPTION¶
Perform force matching (also called multiscale coarse-graining)
OPTIONS¶
Allowed options:
-h [ --help ] display this help and exit
--verbose be loud and noisy
--verbose1 be very loud and noisy
-v [ --verbose2 ] be extremly loud and noisy
--top arg atomistic topology file
--options arg options file for coarse graining
--trj-force arg coarse-grained trajectory containing forces of
already known interactions
Mapping options:
--cg arg coarse graining mapping and bond definitions
(xml-file)
--map-ignore arg list of molecules to ignore separated by ;
--no-map disable mapping and act on original trajectory
Trajectory options:
--trj arg atomistic trajectory file
--begin arg (=0) skip frames before this time (only works for
Gromacs files)
--first-frame arg (=0) start with this frame
--nframes arg process the given number of frames