Wiki
Version 9 (Torsten Kerber, 18/03/2011 10:39) → Version 10/32 (Torsten Kerber, 18/03/2011 10:40)
h1. Introduction
QMX is an QM/MM Embedding Scheme for ASE
h1. Installation
h2. Required Programs
* Python 2.6
* NumPy
h2. Checkout the latest version
@svn checkout https://forge.cbp.ens-lyon.fr/svn/qmx
@
h2. Install the Program (in qmx directory)
install for all users (admin rights might be required)
>@ python setup.py install
@
install for single user only:
>@ python setup.py install --user
@
h1. How to quote
* ASE
* QMX
QMX is an QM/MM Embedding Scheme for ASE
h1. Installation
h2. Required Programs
* Python 2.6
* NumPy
h2. Checkout the latest version
@svn checkout https://forge.cbp.ens-lyon.fr/svn/qmx
@
h2. Install the Program (in qmx directory)
install for all users (admin rights might be required)
>@ python setup.py install
@
install for single user only:
>@ python setup.py install --user
@
h1. How to quote
* ASE
* QMX