coordinates from z-matrices
Regarding the question from Katrina Werpetinski
<WERPETIN()at()ecs.umass.edu>,
>Does anyone have a (preferrably fortran) algorithm for
>converting a Z-matrix (ie bond length, angle, and
>dihedral angle of a set of four atoms) into cartesian
>coordinates?
The QCPE at Indiana University, Bloomington, IN 47405, has many
versatile FORTRAN programs for doing this operation. Contact Mr.
Richard Counts, Director, QCPE, countsr()at()iubacs.bitnet.
From: BOYD DONALD B (MCVAX0::QSAR)
To: VMS MAIL ADDRESSEE (INT::"chemistry()at()ccl.net")
cc: BOYD DONALD B (MCVAX0::QSAR)