csg_resample1
Part of the votca package
Usage
csg_resample [OPTIONS]
csg_resample [--help]
Overview
Change grid and interval of any sort of table files. Mainly called internally by inverse script, can also be used to manually prepare input files for coarse-grained simulations.
Options
Allowed options:
--help produce this help message
--in arg table to read
--out arg table to write
--derivative arg table to write
--grid arg new grid spacing (min:step:max). If 'grid' is specified
only, interpolation is performed.
--type arg (=akima) [cubic|akima|linear]. If option is not specified, the
default type 'akima' is assumed.
--fitgrid arg specify fit grid (min:step:max). If 'grid' and
'fitgrid' are specified, a fit is performed.
--nocut Option for fitgrid: Normally, values out of fitgrid
boundaries are cut off. If they shouldn't, choose
--nocut.
--comment arg store a comment in the output table
--boundaries arg (natural|periodic|derivativezero) sets boundary
conditions
History
- Debian 13 (Trixie): the text shown here
- Debian 12 (Bookworm)
- Debian 11 (Bullseye)
- Debian 10 (Buster)
- Debian 9 (Stretch)
- Debian 8 (Jessie)
--boundaries until Debian 11 (Bullseye);
--comment until Debian 11 (Bullseye);
--derivative until Debian 11 (Bullseye);
--fitgrid until Debian 11 (Bullseye);
--grid until Debian 11 (Bullseye);
--help until Debian 11 (Bullseye);
--in until Debian 11 (Bullseye);
--nocut until Debian 11 (Bullseye);
--out until Debian 11 (Bullseye).