Made the file reading more intelligent in Restraints. No longer gives uninformative seg faults.
Restraint loop is now more versatile
Fixed an algorithm error for thermodynamic integration with charges
working version of simpleBuilder
add getForcefiled into simSetup
Added utility functions to grab the mass from the force field.
Forgot to add them
change parameter of calling sprintf
BASS eradication project (part 3)
BASS eradication project (part 2)
BASS eradication project (part 1)
Fixing required keyword annoyances
warning message for nProcessors > nMolecules
Fixed bug in calc_eam with mixtures and cutoffs associated with mixture.
support SSD_E SSD_RF SSD1
SSDVisitor support SSD_RF, SSD_E, SSD1 now
remove ^M from ZConsReader.cpp
Fixed a bug where eor file wasn't being written at the end of the run
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remove some comment lines
remove an extra semicolon from OOPSEMinimizer.hpp
Fix for thermodynamic integration of rigid bodies
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Makefiles don't belong in repository
Updated configure for new samples
Initial import of OOPSE-1.0 source tree