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Re^2: Freezing all torsion angles
Khimich
khimich@kinet.chem.msu.ru
>First of all, you need to use z-matrixThanks for your reply. But, is it possible to do using internal coordinates?
NZVAR = M
$ Zmat dlc = 1 auto = 1 ...
Thu Apr 8 '10 8:22am
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