AMBER Archive (2004)

Subject: AMBER: TFE parameters

From: Adrian E. Roitberg (roitberg_at_qtp.ufl.edu)
Date: Tue Dec 21 2004 - 14:34:29 CST


Hello all,

is there any one out there with parameters for TFE (Tri-Fluoro-Ethanol)
for simulations in the liquid phase ?

Please share them if possible.

Thanks !!

-- 
                            Dr. Adrian E. Roitberg
                              Associate Professor
               Quantum Theory Project and Department of Chemistry

University of Florida PHONE 352 392-6972 P.O. Box 118435 FAX 352 392-8722 Gainesville, FL 32611-8435 Email adrian_at_qtp.ufl.edu ============================================================================

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