[WIP] [FIX] Implementing Metropolis-Hastings method to optimize ACSFs' parameters.
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- include/4neuro.h 1 addition, 0 deletionsinclude/4neuro.h
- src/CMakeLists.txt 1 addition, 0 deletionssrc/CMakeLists.txt
- src/ErrorFunction/ErrorFunctions.cpp 8 additions, 0 deletionssrc/ErrorFunction/ErrorFunctions.cpp
- src/ErrorFunction/ErrorFunctions.h 4 additions, 0 deletionssrc/ErrorFunction/ErrorFunctions.h
- src/LearningMethods/NelderMead.cpp 1 addition, 1 deletionsrc/LearningMethods/NelderMead.cpp
- src/Network/ACSFNeuralNetwork.cpp 14 additions, 40 deletionssrc/Network/ACSFNeuralNetwork.cpp
- src/Network/ACSFNeuralNetwork.h 10 additions, 0 deletionssrc/Network/ACSFNeuralNetwork.h
- src/Network/NeuralNetwork.cpp 10 additions, 1 deletionsrc/Network/NeuralNetwork.cpp
- src/Network/NeuralNetwork.h 4 additions, 0 deletionssrc/Network/NeuralNetwork.h
- src/Reader/XYZReader.cpp 5 additions, 5 deletionssrc/Reader/XYZReader.cpp
- src/SymmetryFunction/ACSFParametersOptimizer.cpp 148 additions, 0 deletionssrc/SymmetryFunction/ACSFParametersOptimizer.cpp
- src/SymmetryFunction/ACSFParametersOptimizer.h 32 additions, 0 deletionssrc/SymmetryFunction/ACSFParametersOptimizer.h
- src/SymmetryFunction/Element.cpp 2 additions, 2 deletionssrc/SymmetryFunction/Element.cpp
- src/SymmetryFunction/Element.h 1 addition, 1 deletionsrc/SymmetryFunction/Element.h
- src/SymmetryFunction/SymmetryFunction.cpp 78 additions, 27 deletionssrc/SymmetryFunction/SymmetryFunction.cpp
- src/SymmetryFunction/SymmetryFunction.h 33 additions, 18 deletionssrc/SymmetryFunction/SymmetryFunction.h
- src/SymmetryFunction/SymmetryFunctionSerialization.h 0 additions, 3 deletionssrc/SymmetryFunction/SymmetryFunctionSerialization.h
- src/examples/dev_sandbox.cpp 36 additions, 23 deletionssrc/examples/dev_sandbox.cpp
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