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Last change
on this file since ed5f58 was 375dcf, checked in by Frederik Heber <heber@…>, 17 years ago |
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introduced shieldings to analyzer and joiner
both now handle pcp.sigma_all...csv files just as pcp.forces.all. Therefore the data format in pcp/perturbed.c was adapted a bit, as we need a header.
periodentafel.hpp got periodentafel and element class from molecules.hpp
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Property mode
set to
100644
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File size:
833 bytes
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| 1 | SOURCE = atom.cpp bond.cpp boundary.cpp builder.cpp config.cpp element.cpp helpers.cpp molecules.cpp moleculelist.cpp periodentafel.cpp vector.cpp verbose.cpp
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| 2 | HEADER = boundary.hpp defs.hpp helpers.hpp molecules.hpp periodentafel.hpp stackclass.hpp vector.hpp
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| 3 |
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| 4 | bin_PROGRAMS = molecuilder joiner analyzer
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| 5 | molecuilderdir = ${bindir}
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| 6 | molecuilder_DATA = elements.db valence.db orbitals.db Hbonddistance.db Hbondangle.db
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| 7 | molecuilder_SOURCES = ${SOURCE} ${HEADER}
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| 8 | joiner_SOURCES = joiner.cpp datacreator.cpp element.cpp helpers.cpp periodentafel.cpp parser.cpp verbose.cpp datacreator.hpp helpers.hpp parser.hpp periodentafel.hpp
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| 9 | analyzer_SOURCES = analyzer.cpp datacreator.cpp element.cpp helpers.cpp periodentafel.cpp parser.cpp verbose.cpp helpers.hpp periodentafel.hpp parser.hpp datacreator.hpp
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| 10 |
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| 11 |
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| 12 | #EXTRA_DIST = ${molecuilder_DATA}
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