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mk_angndx
Langue: en
Version: 112352 (mandriva - 01/05/08)
Section: 1 (Commandes utilisateur)
NAME
mk_angndx VERSION 3.3_beta_20050823SYNOPSIS
mk_angndx -s topol.tpr -n angle.ndx -[no]h -nice int -type enumDESCRIPTION
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 InputGeneric run input: tpr tpb tpa xml
-n angle.ndx Output
Index file
OTHER OPTIONS
-[no]h noPrint help info and quit
-nice int 0
Set the nicelevel
-type enum angle
Type of angle: angle , g96-angle , dihedral , improper , ryckaert-bellemans or phi-psi
Contenus ©2006-2024 Benjamin Poulain
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