package info
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Folder: MolStandardize
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.. (parent) | |||
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d | rwxr-xr-x | 4,096 | AcidBaseCatalog |
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d | rwxr-xr-x | 4,096 | FragmentCatalog |
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d | rwxr-xr-x | 4,096 | TautomerCatalog |
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d | rwxr-xr-x | 4,096 | TransformCatalog |
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d | rwxr-xr-x | 4,096 | Wrap |
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d | rwxr-xr-x | 133 | test_data |
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- | rw-r--r-- | 2,617 | CMakeLists.txt |
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- | rw-r--r-- | 18,614 | Charge.cpp |
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- | rw-r--r-- | 4,376 | Charge.h |
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- | rw-r--r-- | 8,665 | Fragment.cpp |
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- | rw-r--r-- | 3,547 | Fragment.h |
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- | rw-r--r-- | 7,885 | Metal.cpp |
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- | rw-r--r-- | 1,850 | Metal.h |
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- | rw-r--r-- | 9,188 | MolStandardize.cpp |
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- | rw-r--r-- | 7,206 | MolStandardize.h |
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- | rw-r--r-- | 7,109 | Normalize.cpp |
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- | rw-r--r-- | 3,490 | Normalize.h |
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- | rw-r--r-- | 21,982 | Tautomer.cpp |
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- | rw-r--r-- | 15,993 | Tautomer.h |
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- | rw-r--r-- | 8,432 | Validate.cpp |
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- | rw-r--r-- | 6,880 | Validate.h |
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- | rw-r--r-- | 34,731 | catch_tests.cpp |
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- | rw-r--r-- | 68,751 | test1.cpp |
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- | rw-r--r-- | 6,245 | test2.cpp |
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- | rw-r--r-- | 14,305 | testCharge.cpp |
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- | rw-r--r-- | 13,233 | testFragment.cpp |
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- | rw-r--r-- | 22,152 | testNormalize.cpp |
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- | rw-r--r-- | 11,254 | testPCS.cpp |
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- | rw-r--r-- | 53,429 | testTautomer.cpp |
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- | rw-r--r-- | 11,829 | testValidate.cpp |