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Torsten Kerber, 18/03/2011 10:39


Introduction

QMX is an QM/MM Embedding Scheme for ASE

Installation

Required Programs

  • Python 2.6
  • NumPy

Checkout the latest version

svn checkout https://forge.cbp.ens-lyon.fr/svn/qmx

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

@