mk_angndx

Langue: en

Autres versions - même langue

Version: 314520 (ubuntu - 07/07/09)

Section: 1 (Commandes utilisateur)

Sommaire

NAME

mk_angndx - generates index files for g_angle

VERSION 4.0.1

SYNOPSIS

mk_angndx -s topol.tpr -n angle.ndx -[no]h -nice int -type enum -[no]hyd

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

-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

SEE ALSO

gromacs(7)

More information about GROMACS is available at <http://www.gromacs.org/>.