DOKK / manpages / debian 10 / votca-csg / csg_reupdate.1.en
csg_reupdate(1) General Commands Manual csg_reupdate(1)

csg_reupdate - Part of the VOTCA package

csg_reupdate [OPTION] [OPTIONPARAMETERS]

computes relative entropy update.

Please visit the program site at __http://www.votca.org__.

Allowed options:

display this help and exit
be loud and noisy
atomistic topology file (only needed for RE update)

RE Specific options:

options file for coarse graining
only generate potential tables from given parameters, NO RE update!
[OPTIONAL] generate potential tables only for the specified interactions, only valid when 'gentable' is true
Extension of the input parameter tables
Extension of the output parameter tables
Extension of the output potential tables
Extension of the output potential tables

Threading options:

number of threads

Trajectory options:

atomistic trajectory file
skip frames before this time (only works for Gromacs files)
start with this frame
process the given number of frames

Written and maintained by the VOTCA Development Team <devs@votca.org>

This Manual Page was converted from t2t format to the this format by txt2tags (http://txt2tags.org) ! The t2t file was extracted from 'csg_reupdate --help' by help2t2t (version 1.5 )

Copyright 2009-2011 The VOTCA Development Team (http://www.votca.org)

Licensed under the Apache License, Version 2.0 (the "License"); you may not use this file except in compliance with the License. You may obtain a copy of the License at


http://www.apache.org/licenses/LICENSE-2.0

Unless required by applicable law or agreed to in writing, software distributed under the License is distributed on an "AS IS" BASIS, WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. See the License for the specific language governing permissions and limitations under the License.

2019-02-08 02:59:36 Version: 1.5