[Chimera-users] add atom type in MMTK
Lionel Nauton
lionel.nauton at univ-bpclermont.fr
Fri May 30 05:52:04 PDT 2008
hello everybody
this is my first question since I use chimera, more than 3 years ago,
and I would like to know
if is it possible to add atom type in the MMTK basis set ?
I actually work on a molecule containing platinium, and I can't run mopac
because there is no description.
I'm looking for some description files , and I found this :
/antechamber/dat/antechamber/*****.DAT
which is the good one and which is the way to modify it ?
thank's for your answer and excuse me for my english.....
best regards
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NAUTON Lionel
Ingénieur d'études.
Laboratoire de Synthèse Et Etude de Systèmes à Intérêt Biologique
UMR6504 : université Blaise Pascal – CNRS
24, avenue des Landais – Campus des Cézeaux
63177 AUBIERE Cedex
France
Tel : 04 73 40 55 06
mèl : lionel.nauton at univ-bpclermont.fr
<mailto:lionel.nauton at univ-bpclermont.fr>
site web : http://seesib.univ-bpclermont.fr/site_web/pageaccueil.htm
<http://seesib.univ-bpclermont.fr/site_web/pageaccueil.html>
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