Atomes(1)

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>