 ../
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QuickHull/
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1138
(18 years ago)
by chuckv:
Addded QuickHull to cvs.
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UseTheForce/
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1152
(18 years ago)
by chuckv:
Added metal-nonmetal forcefield.
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antlr/
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1021
(19 years ago)
by gezelter:
starting change of file formats
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applications/
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1144
(18 years ago)
by chuckv:
Removed nanorodBuilder.
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brains/
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1153
(18 years ago)
by chuckv:
Changes for MnM forcefield.
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constraints/
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963
(19 years ago)
by tim:
Adding single precision capabilities to c++ side
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hydrodynamics/
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1129
(18 years ago)
by chrisfen:
SF Lennard-Jones was added for everyones' enjoyment. The behavior is tethered to the electrostaticSummationMethod keyword.
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integrators/
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1145
(18 years ago)
by chuckv:
Starting NPT Langevin. Added new force manager files.
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io/
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1150
(18 years ago)
by chuckv:
Non-bonded interactions added.
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lattice/
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1074
(19 years ago)
by gezelter:
bugfixing shapedLattice to have crystal origin at one of the occupied
lattice sites
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math/
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1143
(18 years ago)
by chuckv:
Pos copied into a malloc array now.
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mdParser/
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1024
(19 years ago)
by tim:
Massive changes preparing for release of OOPSE-4: The main difference
is that the new MD file format (.md, .dump, .eor) now contains meta-data
information along with the configuration information.
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minimizers/
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963
(19 years ago)
by tim:
Adding single precision capabilities to c++ side
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openbabel/
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1084
(19 years ago)
by gezelter:
fixes for open babel
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primitives/
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1126
(18 years ago)
by gezelter:
Massive update to do virials (both atomic and cutoff-group) correctly.
The rigid body constraint contributions had been missing and this was
masked by the use of cutoff groups...
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profiling/
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963
(19 years ago)
by tim:
Adding single precision capabilities to c++ side
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restraints/
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1129
(18 years ago)
by chrisfen:
SF Lennard-Jones was added for everyones' enjoyment. The behavior is tethered to the electrostaticSummationMethod keyword.
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selection/
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963
(19 years ago)
by tim:
Adding single precision capabilities to c++ side
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types/
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1149
(18 years ago)
by chuckv:
Adding support for non-bonded interactions to OOPSE.
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utils/
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1062
(19 years ago)
by gezelter:
fixing bugs in randomBuilder
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visitors/
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1118
(18 years ago)
by chuckv:
Support for printPosOnly in Dump2XYZ.
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config.h.in
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1137
(18 years ago)
by chuckv:
Removed CGAL from OOPSE and replaced it with qhull.
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