IGMPlot 3.16 Optimized IGMplot version able to use wfn/wfx/xyz files

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File List
Here is a list of all documented files with brief descriptions:
[detail level 1 2 3]

▼ src |
▼ include |
ADF_ArrayList.h |
ADF_KFc.h |
ADF_KFReader.h |
eig3.h | Eigen-decomposition for symmetric 3x3 real matrices.Public domain, copied from the public domain Java library JAMA
general.h | All data types and constant data needed by the rest of the program
igmplot.h | Tool for IGMplot main
LocalData.h | Class designed to store Gradient related values and provide some utilities concerning those
NCISolver.h | Solver for NCI instance
Node.h | Worker for one Node of the NCI grid
output.h | Files writing functions
ProgData.h | Contains parameters of the instance
reader.h | Tool functions for reading input data
Results.h | Manage the results of the application
toolbox.h | Generic methods
vmdFileGenerator.h | Header of functions generating vmd files
vmdKeywords.h | Definition of VMD Keywords
WFreader.h | Procedure/Function to manage wave function files (WFN V1.0 and WFX V2.0)
eig3.cpp | Implementation of eig3.h definitions
igmplot.cpp | Main of the IGMplot application
LocalData.cpp | Implementation of LocalData.h definitions
NCISolver.cpp | Implementation of NCISolver.h definition
Node.cpp | Implementation of Node.h
output.cpp | Implementation of methods declared in output.h
ProgData.cpp | Implementation of ProgData description (from ProgData.h)
reader.cpp | Implementation of methods declared in reader.h
Results.cpp | Implementation of Results.h definitions
toolbox.cpp | Implementation of methods declared in toolbox.h
vmdFileGenerator.cpp | Implementation of methods declared in vmdFileGenerator.h
WFreader.cpp | Implementation of the methods declared in WFNreader.h