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xtp_parallel(1) General Commands Manual xtp_parallel(1)

NAME

xtp_parallel - Part of the VOTCA package

For more info please visit http://www.votca.org

SYNOPSIS

xtp_parallel [OPTION] [ARGUMENT]

DESCRIPTION

Runs job-based heavy-duty calculators

OPTIONS


display this help and exit

be loud and noisy

be very loud and noisy

be extremly loud and noisy

calculator options

hdf5 state file, *.hdf5

start from this frame

number of frames to process

number of threads to create

number of openmp threads to create in each thread

whether or not to save changes to state file

restart pattern: 'host(pc1:234) stat(FAILED)'

assigns jobs in blocks of this size

task(s) to perform: write, run, read

maximum number of jobs to process (-1 = inf)
Name of calculator to run
Lists all available calculators
Short description of a calculator

output man-formatted manual pages

output tex-formatted manual pages

AUTHORS

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

COPYRIGHT

Copyright 2009-2020 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.

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