Dear Holger,
thanks for your answers! Before nmode calculation, I'll do just
conjugate grad. mini and hope it'll be enough.
Best regards,
Martin
-----------
Martin Lepsik
Dept. of Molecular Modeling
Institute of Organic Chemistry & Biochemistry
Czech Academy of Sciences
phone: +420-220 183 540
fax:+420-220 183 292
e-mail:lepsik.uochb.cas.cz
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Received on Wed Jan 21 2004 - 13:53:01 PST
