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185ec927ab6f1dfe66401644552286dff41fa359
rdkit
/
Code
/
GraphMol
/
PartialCharges
History
Eisuke Kawashima
185ec927ab
Unset executable flag
2019-10-10 20:18:43 +09:00
..
Wrap
Unset executable flag
2019-10-10 20:18:43 +09:00
CMakeLists.txt
Fixes
#2516
(
#2519
)
2019-06-28 09:57:00 -04:00
GasteigerCharges.cpp
Support for a JSON-based molecule interchange format (
#1798
)
2018-04-02 05:12:03 +02:00
GasteigerCharges.h
clang-tidy-7 pass (
#2408
)
2019-04-16 12:05:47 -04:00
GasteigerParams.cpp
first pass, using google style
2015-11-14 14:58:11 +01:00
GasteigerParams.h
clang-tidy-7 pass (
#2408
)
2019-04-16 12:05:47 -04:00
test1.cpp
moved test.h from RDBoost to RDGeneral for consistency with export.h (
#2074
)
2018-10-11 17:35:23 -04:00