 ../
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VelocityVerletIntegrator.hpp
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417
(20 years ago)
by chrisfen:
First commit of the new restraints code
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VelocityVerletIntegrator.cpp
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471
(20 years ago)
by chrisfen:
minor change to TI output
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Velocitizer.hpp
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392
(20 years ago)
by tim:
remove default parameter from MersenneTwister.hpp which causes all kinds of trouble.
Refactory random number generator
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Velocitizer.cpp
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393
(20 years ago)
by tim:
info_ in Velocitizer is not initialized which causes a seg fault
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RotationAlgorithm.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NVT.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NVT.cpp
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271
(20 years ago)
by tim:
fix a bug in loading initial extended system parameters
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NVE.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NVE.cpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPTxyz.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPTxyz.cpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPTi.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPTi.cpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPTf.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPTf.cpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPT.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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NPT.cpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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Makefile
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267
(20 years ago)
by gezelter:
moved Package variable into subdirectory makefiles to speed up
the building process
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IntegratorFactory.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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IntegratorFactory.cpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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IntegratorCreator.hpp
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385
(20 years ago)
by tim:
fix compilation problem for g++ 3.4
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Integrator.hpp
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417
(20 years ago)
by chrisfen:
First commit of the new restraints code
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Integrator.cpp
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441
(20 years ago)
by gezelter:
VelocityVerletIntegrator already deletes and Nullifies restWriter,
so Integrator shouldn't do it.
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DLM.hpp
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246
(20 years ago)
by gezelter:
merging new_design branch into OOPSE-2.0
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DLM.cpp
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273
(20 years ago)
by tim:
(1) complete section parser's error message
(2) add GhostTorsion
(3) accumulate inertial tensor from the directional atoms before calculate rigidbody's inertial tensor
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