From: Randy J. Zauhar (r.zauhar_at_usciences.edu)
Date: Tue Dec 11 2018 - 13:27:00 CST
Do usee-defined force field elements, in particular the 'grid-steered’ option, work with alchemical free energy perturbation?
Randy J. Zauhar, PhD
Prof. of Biochemistry
Dept. of Chemistry & Biochemistry
University of the Sciences in Philadelphia
600 S. 43rd Street
Philadelphia, PA 19104
“Yeah the night is gonna fall, and the vultures will surround you /
And when you’re lookin’ in the mirror what you see is gon’ astound you"
— Death Cab for Cutie, “Monday Morning"
This archive was generated by hypermail 2.1.6 : Tue Dec 31 2019 - 23:20:23 CST