NAME

csg_call potential shift - Part of the VOTCA package

SYNOPSIS

csg_call potential shift [OPTIONS]

csg_call potential shift [–help]

Usage: csg_call [OPTIONS] potential shift [OPTIONS] <in> <out>

DESCRIPTION

This script shifts the whole potential by minimum (bonded potentials) or last value (non-bonded potentials).

EXAMPLES

* potential_shift.pl --type bond table.in table.out

OPTIONS

Allowed options:

-h, --help            show this help message
--type XXX            change the type of potential
                      Default: non-bonded

Possible types: non-bonded, bond, angle, dihedral, bonded