topjoinmol

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topjoinmol: version 2.231.418d045(2020-03-01 18:49) [CATs - Conversion And Analysis Tools]

Name

topjoinmol

Synopsis

topjoinmol OPTIONS [--] OLD NEW

Description

Change the information about molecules used during pressure scalling.

Arguments

OLD
old topology name. If - is provided then topology is read from standard input stream.
NEW
new topology name. If - is provided then topology is written to standard output stream.

Options

-n, --nmol NUM
number of molecules to be connected together
(Default: 0)
-v, --verbose
increase output verbosity
--version
output version information and exit
-h, --help
display this help and exit