Mercurial > repos > marcel > caddsuite_mac10_6
diff CADDSuite-1.6/data/OpenBabel/mmff94.ff @ 10:eda78e0f5df6 draft default tip
Deleted selected files
author | marcel |
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date | Sun, 30 Nov 2014 03:46:08 -0500 |
parents | 488032d372e1 |
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--- a/CADDSuite-1.6/data/OpenBabel/mmff94.ff Sat Dec 15 13:16:40 2012 -0500 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,28 +0,0 @@ -# -# MMFF94 paremeter files -# - -# atom properties -prop mmffprop.par -# fallback defs -def mmffdef.par -# bond stretching parameters -bond mmffbond.par -# angle bending parameters -ang mmffang.par -# empirical rule parameters (bond stretching) -bndk mmffbndk.par -# charge parameters -chg mmffchg.par -# empirical rule parameters (bend-stretch) -dfsb mmffdfsb.par -# out-of-plane parameters -oop mmffoop.par -# partial bond charge increments -pbci mmffpbci.par -# strech-bend parameters -stbn mmffstbn.par -# torsion parameters -tor mmfftor.par -# van der waals parameters -vdw mmffvdw.par