 ../
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LDForceManager.cpp
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3126
(17 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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VelocityVerletIntegrator.cpp
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3126
(17 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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LDForceManager.hpp
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3126
(17 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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Velocitizer.cpp
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3055
(17 years ago)
by gezelter:
Added velocitizer utility program, added samples of its use to the
builder samples.
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Makefile
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2994
(17 years ago)
by gezelter:
adding NgammaT integrator
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NgammaT.hpp
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2994
(17 years ago)
by gezelter:
adding NgammaT integrator
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NgammaT.cpp
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2994
(17 years ago)
by gezelter:
adding NgammaT integrator
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Integrator.cpp
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2879
(18 years ago)
by chrisfen:
MPI thermodynamic integration works now.
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NPAT.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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Velocitizer.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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NPTi.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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LangevinDynamics.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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NVE.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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NPTxyz.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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NPrT.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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NPT.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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RotationAlgorithm.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
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NVT.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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NPTxyz.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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DLM.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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NVT.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
VelocityVerletIntegrator.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
NPAT.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
NPrT.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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NPTf.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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Integrator.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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NPT.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
NVE.hpp
|
2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
NPTf.hpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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LangevinDynamics.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
NPTi.cpp
|
2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
|
DLM.cpp
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2759
(18 years ago)
by tim:
Adding single precision capabilities to c++ side
|
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IntegratorFactory.hpp
|
2404
(18 years ago)
by chrisfen:
fixed a capitalization problem with NPT integrator initialization
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IntegratorFactory.cpp
|
2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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IntegratorCreator.hpp
|
2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
|
