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Re^3: Freezing all torsion angles
Denis Zavelev
denis.zavelev@gmail.com
>Thanks for your reply. But, is it possible to do using internal coordinates?
>NZVAR = M
>$ Zmat dlc = 1 auto = 1 ...
Please read the documentation for $ZMAT section. Unfortunately, I haven't got any experience of computations using DLC.
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Thu Apr 8 '10 2:22pm
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