mk_angndx(1) GROMACS suite, VERSION 4.5.4-dev-20110404-bc5695c mk_angndx(1)
NAME
mk_angndx - generates index files for g_angle
VERSION 4.5.4-dev-20110404-bc5695c
SYNOPSIS
mk_angndx -s topol.tpr -n angle.ndx -[no]h -[no]version -nice int -type enum -[no]hyd -hq real
DESCRIPTION
mk_angndx makes an index file for calculation of angle distributions etc. It uses a run input file ( .tpx) for the definitions of the
angles, dihedrals etc.
FILES
-s topol.tpr Input
Run input file: tpr tpb tpa
-n angle.ndx Output
Index file
OTHER OPTIONS
-[no]hno
Print help info and quit
-[no]versionno
Print version info and quit
-nice int 0
Set the nicelevel
-type enum angle
Type of angle: angle, dihedral, improper or ryckaert-bellemans
-[no]hydyes
Include angles with atoms with mass 1.5
-hq real -1
Ignore angles with atoms with mass 1.5 and |q| hq
SEE ALSO
gromacs(7)
More information about GROMACS is available at <http://www.gromacs.org/>.
Mon 4 Apr 2011 mk_angndx(1)
