Last change
on this file since 0ab37b was 0ab37b, checked in by Frederik Heber <heber@…>, 17 years ago |
new helper BOSSMatcher compares config files against results to check for messes in the order.
Compares coordinates in pcp.forces.all against those in the config file to check whether BondFragment01.conf and BondFragment01/ are really still the same.
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Property mode
set to
100644
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File size:
828 bytes
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1 |
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2 | bin_PROGRAMS = \
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3 | average \
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4 | CreateGaAs \
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5 | CreateH2 \
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6 | diagonalize \
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7 | GetPdb \
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8 | NanoCreator \
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9 | ReadSrcIon \
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10 | stochastik \
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11 | VibrAlyzer
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12 |
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13 | average_SOURCES = average.cpp
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14 | CreateGaAs_SOURCES = CreateGaAs.c
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15 | CreateH2_SOURCES = CreateH2.c
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16 | diagonalize_SOURCES = diagonalize.c
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17 | GetPdb_SOURCES = GetPdb.c mergesort.c mergesort.h
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18 | NanoCreator_SOURCES = NanoCreator.c NanoCreator.h
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19 | ReadSrcIon_SOURCES = ReadSrcIon.c
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20 | stochastik_SOURCES = stochastik.cpp
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21 | VibrAlyzer_SOURCES = VibrAlyzer.c
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22 |
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23 | scripts = \
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24 | average_result.sh \
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25 | CreateFromXYZ.sh \
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26 | CalculateDensity.sh \
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27 | CalculateMass.sh \
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28 | config2xyz.sh \
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29 | convert2old.sh \
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30 | convertpdb.sh \
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31 | dynamicANOVA.sh \
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32 | gather_result.sh \
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33 | gather_all_results.sh \
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34 | grep_shielding.sh \
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35 | gather_averaged_results.sh \
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36 | meas2pdb.sh \
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37 | BOSSMatcher.pl \
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38 | Nanotubes.pl \
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39 | ReSequenceDX.pl
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40 |
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41 | bin_SCRIPTS = ${scripts}
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42 |
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