M.E. Clamp (mbclm at s-crim1.dl.ac.uk) wrote:
: Hello,
: Does anyone have or know the whereabouts of any code to convert dihedrals to
: cartesian coordinates. I know that Brookhaven has a program to convert
: coords to dihedrals but nothing on the reverse transformation.
: Thank you
: Michele Clamp
As part of the DIANA distance geometry program, one gets COFIMA (COordinate
FIle MAnipulation), which can among other things take an angle file and
calculate coordinates from it. Being an ASCII file, this angle file should be
trivial to construct from scratch, or from another file format.
Contact Peter Guentert (guentert at mol.biol.ethz.ch) for details.
Hope this helps,
Christoph
--
Christoph Weber email: cweber at oci.unizh.ch
OCI Uni Zurich phone: +41 1 257 4925
Winterthurerstr. 190 FAX: +41 1 361 9895
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