Package: wnpp Severity: wishlist Owner: Drew Parsons <[email protected]> X-Debbugs-Cc: [email protected], [email protected], [email protected]
* Package name : igmplot Version : 3.17 Upstream Contact: Jean-Charles Boisson <[email protected]> * URL : http://igmplot.univ-reims.fr/ * License : CeCILL-c Programming Lang: C++ Description : identify, characterize, and quantify molecular interactions IGMPlot: Independent Gradient Model Plot By using IGMPlot you can identify and quantify molecular interactions over a broad range: from non-covalent to covalent bonding, through metal coordination. This tool can be helpful for interpretation accessible to a wide community of chemists (organic, inorganic chemistry, including transition metal complexes and reaction mechanisms). The CeCILL-c licence (http://cecill.info/index.en.html) is used by other debian packages (scotch, mumps). A new ADF library (contact Alexei Yakovlev, SCM) introduced in this version of IGMPlot is provided under the GNU Lesser General Public License (LGPL), version 3. To be maintained with the Debichem team alongside other quantum chemical packages such as nwchem, which can generate the wavefunction files used by IGMPlot.
