NAME

       atomes - a toolbox to analyze, visualize and create/edit 3D atomistic models

SYNOPSIS

       atomes [options] files...

DESCRIPTION

       This manual page documents briefly the atomes command.

       atomes is a toolbox to analyze, visualize and edit/create 3D atomistic models.

       It  offers  a  workspace  to  open  and manage project(s) that can exchange data: analysis
       results, atomic coordinates ...

       atomes also provides an advanced input preparation system for calculations using well know
       molecular dynamics codes:

              Classical MD: DLPOLY and LAMMPS
              Ab-initio MD: CPMD and CP2K
              QM-MM MD: CPMD and CP2K

OPTIONS

       This  program  follows  the usual GNU command line syntax, with long options starting with
       two dashes (`-').  A summary of options is included below.  For  a  complete  description,
       see the Info files.

       -awf, -AWF
              Open atomes workspace file.

       -apf, -APF
              Open atomes project file(s).

       -xyz, -XYZ
              Import XYZ atomic coordinates(s).

       -pdb, -PDB
              Import PDB atomic coordinates(s).

       -cif, -CIF
              Import CIF atomic coordinate(s).

       -h, --help
              Show summary of options.

       -v, --version
              Show version of program.

SEE ALSO

       https://atomes.ipcms.fr/

AUTHOR

       This manual page was created by Sébastien Le Roux <sebastien.leroux@ipcms.unistra.fr>

                                        September  2 2022                               Atomes(1)