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    FitCompoundPotentialAction.cpp
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    4.3 KB
    
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    9eb71b3
     
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    9 years
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  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    FitCompoundPotentialAction.def
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    2.3 KB
    
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    b40690
     
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    10 years
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  FrederikHeber | 
  
    Fit..PotentialAction now allow setting maximum number of optimization …
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    FitCompoundPotentialAction.hpp
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    400 bytes
    
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    98d166
     
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    11 years
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  FrederikHeber | 
  
    Split FitPotentialAction into two actions.
- FitPotentialAction fits …
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    FitPartialChargesAction.cpp
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    23.3 KB
    
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    9eb71b3
     
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    9 years
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  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    FitPartialChargesAction.def
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    1.6 KB
    
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    d8ed62
     
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    9 years
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  FrederikHeber | 
  
    Rewrote FitPartialChargesAction to fit charges to currently selected …
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    FitPartialChargesAction.hpp
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    388 bytes
    
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    50d49d
     
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    10 years
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  FrederikHeber | 
  
    FIX: Renamed FitParticleCharges -> FitPartialCharges.
- fitting …
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    FitPotentialAction.cpp
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    5.6 KB
    
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    9eb71b3
     
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    9 years
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  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    FitPotentialAction.def
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    2.6 KB
    
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    b40690
     
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    10 years
   | 
  FrederikHeber | 
  
    Fit..PotentialAction now allow setting maximum number of optimization …
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    FitPotentialAction.hpp
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    360 bytes
    
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    f5724f
     
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    12 years
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  FrederikHeber | 
  
    Moved all FragmentationActions related to potentials into own menu and …
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    ParseAtomFragmentsAction.cpp
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    4.0 KB
    
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    9eb71b3
     
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    9 years
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  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    ParseAtomFragmentsAction.def
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    1.2 KB
    
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    78202b
     
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    9 years
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  FrederikHeber | 
  
    Adding potential action to parse and save atom fragment associations.
 …
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    ParseAtomFragmentsAction.hpp
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    390 bytes
    
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    78202b
     
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    9 years
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  FrederikHeber | 
  
    Adding potential action to parse and save atom fragment associations.
 …
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    ParseHomologiesAction.cpp
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    3.7 KB
    
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    9eb71b3
     
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    9 years
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  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    ParseHomologiesAction.def
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    1.2 KB
    
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    f5724f
     
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    12 years
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  FrederikHeber | 
  
    Moved all FragmentationActions related to potentials into own menu and …
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    ParseHomologiesAction.hpp
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    375 bytes
    
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    f5724f
     
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    12 years
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  FrederikHeber | 
  
    Moved all FragmentationActions related to potentials into own menu and …
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    ParseParticleParametersAction.cpp
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    3.0 KB
    
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    9eb71b3
     
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    9 years
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  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    ParseParticleParametersAction.def
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    1.4 KB
    
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    2082637
     
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    10 years
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  FrederikHeber | 
  
    Added Parse- and SaveParticleParametersAction to parse/save …
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    ParseParticleParametersAction.hpp
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    415 bytes
    
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    2082637
     
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    10 years
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  FrederikHeber | 
  
    Added Parse- and SaveParticleParametersAction to parse/save …
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    ParsePotentialsAction.cpp
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    3.9 KB
    
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    da7ef9
     
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    8 years
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  frederik.heber | 
  
    FIX: STATUS msg only pushed to GUI, now also always in log.
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    ParsePotentialsAction.def
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    1.3 KB
    
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    f1eabd
     
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    11 years
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  FrederikHeber | 
  
    Extracted ParsePotentialsAction from FitCompoundPotentialAction.
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    ParsePotentialsAction.hpp
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    375 bytes
    
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    f1eabd
     
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    11 years
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  FrederikHeber | 
  
    Extracted ParsePotentialsAction from FitCompoundPotentialAction.
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    SaveAtomFragmentsAction.cpp
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    3.3 KB
    
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    9eb71b3
     
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    9 years
   | 
  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    SaveAtomFragmentsAction.def
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    1.3 KB
    
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    78202b
     
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    9 years
   | 
  FrederikHeber | 
  
    Adding potential action to parse and save atom fragment associations.
 …
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    SaveAtomFragmentsAction.hpp
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    385 bytes
    
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    78202b
     
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    9 years
   | 
  FrederikHeber | 
  
    Adding potential action to parse and save atom fragment associations.
 …
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    SaveHomologiesAction.cpp
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    3.2 KB
    
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    9eb71b3
     
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    9 years
   | 
  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    SaveHomologiesAction.def
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    1.2 KB
    
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    f5724f
     
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    12 years
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  FrederikHeber | 
  
    Moved all FragmentationActions related to potentials into own menu and …
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    SaveHomologiesAction.hpp
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    370 bytes
    
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    f5724f
     
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    12 years
   | 
  FrederikHeber | 
  
    Moved all FragmentationActions related to potentials into own menu and …
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    SaveParticleParametersAction.cpp
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    3.2 KB
    
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    9eb71b3
     
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    9 years
   | 
  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    SaveParticleParametersAction.def
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    1.3 KB
    
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    2082637
     
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    10 years
   | 
  FrederikHeber | 
  
    Added Parse- and SaveParticleParametersAction to parse/save …
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    SaveParticleParametersAction.hpp
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    410 bytes
    
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    2082637
     
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    10 years
   | 
  FrederikHeber | 
  
    Added Parse- and SaveParticleParametersAction to parse/save …
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    SavePotentialsAction.cpp
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    3.1 KB
    
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    9eb71b3
     
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    9 years
   | 
  frederik.heber | 
  
    Commented out MemDebug include and Memory::ignore.
- MemDebug clashes …
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    SavePotentialsAction.def
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    1.2 KB
    
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    0ea063
     
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    11 years
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  FrederikHeber | 
  
    Extracted SavePotentialsAction.
- PotentialTrainer::StorePotentials …
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    SavePotentialsAction.hpp
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    370 bytes
    
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    0ea063
     
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    11 years
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  FrederikHeber | 
  
    Extracted SavePotentialsAction.
- PotentialTrainer::StorePotentials …
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