[Molvis-list] listing of internal coordinates

Eric Martz emartz at microbio.umass.edu
Sat Mar 15 14:57:11 EDT 2008


Dear Eric,

I think your question is more likely to get an answer on the pdb-l:
http://www.pdb.org/pdb/static.do?p=education_discussion/discussion_forum/index.html

Good luck, -Eric

At 3/14/08, Eric Germaneau wrote:
>Dear all,
>
>I'm looking for a program or an algorithm which output all :
>
>* bonds
>* valence angles
>* dihedral angles
>* improper dihedral angles
>* inversion angles
>* out of plans
>
>for a given molecule.
>
>Or a free program which set amber atom type from a pdb or xyz structure.
>
>Do you have an idea?
>Thanks in advance,
>
>                                                            Eric.
>--
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