Cremer - Pople parameters

Dmitri V Mikhailov mikha001 at MAROON.TC.UMN.EDU
Wed Jan 22 12:54:13 EST 1997

Dear Netters,
I need to calculate Cremer - Pople ring puckering parameters
(Cremer and Pople, J.Amer.Chem.Soc. 97, 1354-1358 (1975))
for trajectories generated with Biosym/MSI software.
Can someone point me to any available C or Fortran routines
which do this sort of calculation.

Dmitri Mikhailov
Ph.D. student
Univ. of Minnesota Medical School
Department of Biochemistry
Box 609, 420 Delaware St. SE
Minneapolis MN 55455

tel. (612) 624-7107
fax. (612) 626-2325
e-mail: mikha001 at maroon.tc.umn.edu

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