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High Activity
Commits
: Listings
Analyzed
1 day
ago. based on code collected
2 days
ago.
Jun 21, 2024 — Jun 21, 2025
Showing page 300 of 338
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initial version of Tversky similarity (feature request 2015633) along with a bit of refactoring http://sourceforge.net/tracker/index.php?func=detail&aid=2015633&group_id=160139&atid=814653
Greg Landrum
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almost 17 years ago
minor cleanup and documentation
Greg Landrum
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almost 17 years ago
minor cleanup and documentation
glandrum
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almost 17 years ago
update the chirality from 3d stuff a bit and expose it to python; fix a reporting error in SDMolSupplier
Greg Landrum
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almost 17 years ago
update the chirality from 3d stuff a bit and expose it to python; fix a reporting error in SDMolSupplier
glandrum
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almost 17 years ago
remove a compiler warning
glandrum
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almost 17 years ago
remove a compiler warning
Greg Landrum
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almost 17 years ago
finish cleaning up the base64 code and fixing a core leak; add a test as well
Greg Landrum
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almost 17 years ago
finish cleaning up the base64 code and fixing a core leak; add a test as well
glandrum
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almost 17 years ago
not done with this change yet, but need to change machines
glandrum
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almost 17 years ago
not done with this change yet, but need to change machines
Greg Landrum
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almost 17 years ago
get rid of those irritating POSIX_C_SOURCE warnings
Greg Landrum
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almost 17 years ago
get rid of those irritating POSIX_C_SOURCE warnings
glandrum
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almost 17 years ago
this is a mass of cleanup stuff; mostly line endings
glandrum
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almost 17 years ago
this is a mass of cleanup stuff; mostly line endings
Greg Landrum
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almost 17 years ago
these are no longer needed
Greg Landrum
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almost 17 years ago
these are no longer needed
glandrum
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almost 17 years ago
support taking streams in ctors for suppliers
glandrum
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almost 17 years ago
support taking streams in ctors for suppliers
Greg Landrum
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almost 17 years ago
forgot to check this in so that the win build works correctly
glandrum
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almost 17 years ago
forgot to check this in so that the win build works correctly
Greg Landrum
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almost 17 years ago
merge revs 736:741 from branch http://rdkit.svn.sourceforge.net/svnroot/rdkit/branches/NumPyPort_27June2008 This removes the numeric python dependency and switches to relying on numpy. current status of tests from branch: pass on lin32 and 64 and win32.
Greg Landrum
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almost 17 years ago
merge revs 736:741 from branch http://rdkit.svn.sourceforge.net/svnroot/rdkit/branches/NumPyPort_27June2008
glandrum
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almost 17 years ago
get this working with a jar instead of a directory full of class files
Greg Landrum
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almost 17 years ago
get this working with a jar instead of a directory full of class files
glandrum
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almost 17 years ago
a bit of optimization and code cleanup
glandrum
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almost 17 years ago
a bit of optimization and code cleanup
Greg Landrum
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almost 17 years ago
a bit of optimization and code cleanup
glandrum
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almost 17 years ago
a bit of optimization and code cleanup
Greg Landrum
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almost 17 years ago
- support splitting a molecule into fragments (in MolOps)
glandrum
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almost 17 years ago
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