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dreiding

README
ch3oh.box.dreiding.bgf
ch3oh.box.dreiding.cerius2.eng.dat
data.dreiding
in.dreiding
log.15May15.dreiding.g++.1
log.15May15.dreiding.g++.4

README

The LAMMPS input script and data file were built to match the Cerius Dreiding files included in this directory (ch3oh.box.*) so that you can compare LAMMPS output to a Dreiding implementation in the Cerius code.

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