[AMBER] dihedral scanning with GAFF and GAFF2

From: Qasim Pars <qasimpars.gmail.com>
Date: Fri, 26 Apr 2019 13:22:33 +0300

Dear users,

I would do the dihedral scanning (in different angles such as
0,15,30,...,360^o) for a dihedral angle of a molecule, then plot the
relative energy vs dihedral angles. Is there a tool to do the dihedral
scanning for a molecule which has GAFF or GAFF2 parameters?

Thanks in advance,

Qasim Pars
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Received on Fri Apr 26 2019 - 03:30:03 PDT
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