Greg Landrum 29da37319d fixes to get things working on linux using ChemTransforms

2006-09-23 05:32:47 +00:00

..

test_data

initial import

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Atom.cpp

setup svn keywords (should have done this before import... grn)

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Bond.cpp

setup svn keywords (should have done this before import... grn)

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Conformer.cpp

setup svn keywords (should have done this before import... grn)

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Mol.cpp

try to get ChemTransforms checked in

2006-07-18 05:33:58 +00:00

MolOps.cpp

SDMolSupplier: don't throw on errors parsing molecules. This allows the parsing of further mols to continue.

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MolSupplier.h

initial import

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Queries.cpp

setup svn keywords (should have done this before import... grn)

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rdchem.cpp

setup svn keywords (should have done this before import... grn)

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rdchem.h

initial import

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rdmolfiles.cpp

try to get ChemTransforms checked in

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rdmolfiles.h

initial import

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rdmolops.cpp

setup svn keywords (should have done this before import... grn)

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rdmolops.h

initial import

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rough_test.py

handle the NoImplicit flag properly

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SDMolSupplier.cpp

setup svn keywords (should have done this before import... grn)

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SDWriter.cpp

setup svn keywords (should have done this before import... grn)

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seqs.hpp

initial import

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setup.py

fixes to get things working on linux using ChemTransforms

2006-09-23 05:32:47 +00:00

SmilesMolSupplier.cpp

setup svn keywords (should have done this before import... grn)

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SmilesWriter.cpp

setup svn keywords (should have done this before import... grn)

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Table.cpp

setup svn keywords (should have done this before import... grn)

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TDTMolSupplier.cpp

setup svn keywords (should have done this before import... grn)

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TDTWriter.cpp

setup svn keywords (should have done this before import... grn)

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test_list.py

initial import

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test.py

initial import

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testConformer.py

setup svn keywords (should have done this before import... grn)

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UnitTestWrap.py

initial import

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wrapGraphMol.vcproj

- Get windows debug builds working

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wrapMolFiles.vcproj

- Get windows debug builds working

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wrapMolOps.vcproj

- Get windows debug builds working

2006-05-11 00:42:39 +00:00