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../
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InternalCoordinates
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4e6a60
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11 years
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FrederikHeber |
Added CoordinatorFactory that returns the correct Coordinator for a …
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Particles
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bcf351
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8 years
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FrederikHeber |
MEMFIX: ParticleRegistry did not cleanup on dstor.
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Specifics
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4ecb2d
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8 years
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FrederikHeber |
Moved LinearAlgebra sub-package into ThirdParty folder.
- needed to …
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unittests
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4ecb2d
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8 years
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FrederikHeber |
Moved LinearAlgebra sub-package into ThirdParty folder.
- needed to …
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BindingModel.cpp
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1.7 KB
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bc069f
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8 years
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FrederikHeber |
Added BindingModel which extends HomologyGraph for an ordered set of …
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BindingModel.hpp
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1.6 KB
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bc069f
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8 years
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FrederikHeber |
Added BindingModel which extends HomologyGraph for an ordered set of …
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CompoundPotential.cpp
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18.4 KB
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e60558
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8 years
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FrederikHeber |
Extractors require additionally the binding graph of the fragment …
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CompoundPotential.hpp
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6.8 KB
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e60558
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8 years
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FrederikHeber |
Extractors require additionally the binding graph of the fragment …
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EmpiricalPotential.hpp
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2.9 KB
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9c793c
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8 years
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FrederikHeber |
All ..Potentials now return BindingModel instead of HomologyGraph, …
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Exceptions.hpp
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1.1 KB
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fdfc52
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9 years
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FrederikHeber |
Renamed all SerializablePotential..Exceptions to …
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helpers.hpp
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2.6 KB
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e1fe7e
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11 years
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FrederikHeber |
FunctionModel now uses list_of_arguments to split sequence of subsets …
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Makefile.am
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6.5 KB
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bc069f
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8 years
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FrederikHeber |
Added BindingModel which extends HomologyGraph for an ordered set of …
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PartialNucleiChargeFitter.cpp
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14.8 KB
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9afdef
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8 years
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FrederikHeber |
WARNFIX: PartialNucleiChargeFitter::PartialNucleiChargeFitter has …
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PartialNucleiChargeFitter.hpp
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5.7 KB
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e6a2ef
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8 years
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FrederikHeber |
Extracted PartialNucleiChargeFitter::calculateResiduum().
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ParticleTypeCheckers.cpp
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3.2 KB
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b760bc3
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12 years
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FrederikHeber |
Added ParticleTypeChecker functions in own namespace and added checks …
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ParticleTypeCheckers.hpp
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1.2 KB
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b760bc3
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12 years
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FrederikHeber |
Added ParticleTypeChecker functions in own namespace and added checks …
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PotentialFactory.cpp
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5.2 KB
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f6abb1
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9 years
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FrederikHeber |
PotentialFactory now also complies to templated StreamFactory.
- this …
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PotentialFactory.hpp
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1.8 KB
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f6abb1
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9 years
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FrederikHeber |
PotentialFactory now also complies to templated StreamFactory.
- this …
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PotentialRegistry.cpp
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1.7 KB
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96c7d2
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10 years
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FrederikHeber |
MEMFIX: PotentialRegistry's dstor forgot cleanup().
- also we purge …
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PotentialRegistry.hpp
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1.3 KB
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96c7d2
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10 years
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FrederikHeber |
MEMFIX: PotentialRegistry's dstor forgot cleanup().
- also we purge …
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PotentialTrainer.cpp
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9.2 KB
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c5e75f3
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8 years
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FrederikHeber |
ParticleType_t is now an unsigned int.
- this allows direct use of …
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PotentialTrainer.hpp
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1.8 KB
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945797
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8 years
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FrederikHeber |
FIX: PotentialTrainer::getFirstGraphwithSpecifiedElements() did not …
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RegistryDeserializer.hpp
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1.3 KB
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fde8e7
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9 years
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FrederikHeber |
Refactored PotentialSerializer and -Deserializer into more general …
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RegistryDeserializer_impl.hpp
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1.6 KB
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d24750
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8 years
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FrederikHeber |
FIX: RegistryDeserializer stumbled over comments.
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RegistrySerializer.hpp
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1.3 KB
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d96482
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9 years
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FrederikHeber |
Added specialization of RegistrySerializer for Particle.
- this also …
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RegistrySerializer_impl.hpp
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760 bytes
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fde8e7
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9 years
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FrederikHeber |
Refactored PotentialSerializer and -Deserializer into more general …
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RegistrySerializer_Particle.cpp
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1.9 KB
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d96482
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9 years
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FrederikHeber |
Added specialization of RegistrySerializer for Particle.
- this also …
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SerializablePotential.cpp
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6.3 KB
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fdfc52
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9 years
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FrederikHeber |
Renamed all SerializablePotential..Exceptions to …
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SerializablePotential.hpp
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5.4 KB
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c5e75f3
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8 years
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FrederikHeber |
ParticleType_t is now an unsigned int.
- this allows direct use of …
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StreamFactory.hpp
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678 bytes
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086e30
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9 years
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FrederikHeber |
Added ParticleFactory and general StreamFactory.
- StreamFactory …
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StreamFactory_EmpiricalPotential.cpp
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1.7 KB
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f6abb1
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9 years
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FrederikHeber |
PotentialFactory now also complies to templated StreamFactory.
- this …
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StreamFactory_EmpiricalPotential.hpp
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1.3 KB
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f6abb1
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9 years
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FrederikHeber |
PotentialFactory now also complies to templated StreamFactory.
- this …
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TremoloPotentialFileParser.cpp
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5.0 KB
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a44d70
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9 years
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FrederikHeber |
Placed all TREMOLO Potential parsing into distinct structure.
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TremoloPotentialFileParser.hpp
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1.0 KB
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a44d70
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9 years
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FrederikHeber |
Placed all TREMOLO Potential parsing into distinct structure.
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TremoloPotentialTypes.cpp
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3.2 KB
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afb7c0
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9 years
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FrederikHeber |
Added TremoloPotentialTypes that contains map on tremolo potential …
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TremoloPotentialTypes.hpp
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1.9 KB
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afb7c0
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9 years
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FrederikHeber |
Added TremoloPotentialTypes that contains map on tremolo potential …
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