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rdkit 202009.4-1
  • links: PTS, VCS
  • area: main
  • in suites: bullseye
  • size: 129,624 kB
  • sloc: cpp: 288,030; python: 75,571; java: 6,999; ansic: 5,481; sql: 1,968; yacc: 1,842; lex: 1,254; makefile: 572; javascript: 461; xml: 229; fortran: 183; sh: 134; cs: 93

Folder: ChemReactions

d .. (parent)
d d rwxr-xr-x 4,096 Enumerate
d d rwxr-xr-x 4,096 Wrap
d d rwxr-xr-x 4,096 testData
d d rwxr-xr-x 45 tutorial
- - rw-r--r-- 2,280 CMakeLists.txt
- - rw-r--r-- 6,535 DaylightParser.cpp
- - rw-r--r-- 14,484 MDLParser.cpp
- - rw-r--r-- 3,743 MoleculeParser.cpp
- - rw-r--r-- 2,993 PNGParser.cpp
- - rw-r--r-- 3,592 PreprocessRxn.cpp
- - rw-r--r-- 2,874 PreprocessRxn.h
- - rw-r--r-- 25,117 Reaction.cpp
- - rw-r--r-- 18,434 Reaction.h
- - rw-r--r-- 3,877 ReactionDepict.cpp
- - rw-r--r-- 8,948 ReactionFingerprints.cpp
- - rw-r--r-- 5,859 ReactionFingerprints.h
- - rw-r--r-- 9,762 ReactionParser.h
- - rw-r--r-- 8,795 ReactionPickler.cpp
- - rw-r--r-- 4,305 ReactionPickler.h
- - rw-r--r-- 66,195 ReactionRunner.cpp
- - rw-r--r-- 4,685 ReactionRunner.h
- - rw-r--r-- 13,601 ReactionUtils.cpp
- - rw-r--r-- 3,151 ReactionUtils.h
- - rw-r--r-- 6,823 ReactionWriter.cpp
- - rw-r--r-- 13,238 SanitizeRxn.cpp
- - rw-r--r-- 6,552 SanitizeRxn.h
- - rw-r--r-- 22,988 catch_tests.cpp
- - rw-r--r-- 1,747 license.txt
- - rw-r--r-- 258,384 testReaction.cpp
- - rw-r--r-- 23,914 testReactionFingerprints.cpp