DSSP like program in FORTRAN?
misrael at csi.uottawa.ca
Fri Sep 9 12:29:02 EST 1994
In article <Cvu2An.EzE at ucdavis.edu>, Hemant Varma <varma at okra.ece.ucdavis.edu> writes:
> I was wondering if anybody knows whether a program similar to DSSP
> is available anywhere at any ftp site, but written in FORTRAN.
DEFINE_STRUCTURE, by Richards, Kundrot, and Kahn, is in
FORTRAN. Like DSSP, it's not public domain, but it's free if
you sign a licence. Contact Art Perlo (perlo at csb.yale.edu)
to get it.
> I want to write a program that is similar to DSSP but to try and
> get the coordinates of the the Center of Mass of the side chain
> atoms output along with the C-alphas.
You might ask DSSP co-author Chris Sander (sander at embl-heidelberg.de)
if he'd be willing to make this modification for you. It sounds simple,
and he's a helpful man.
misrael at csi.uottawa.ca Mark Israel
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