This website requires JavaScript.
Explore
Help
Sign In
pub_soft
/
rdkit
Watch
3
Star
0
Fork
0
You've already forked rdkit
mirror of
https://github.com/rdkit/rdkit.git
synced
2026-06-06 22:39:55 +08:00
Code
Issues
Packages
Projects
Releases
Wiki
Activity
Files
d0c8c3cf8f4a1044493b85661e00fba767210842
rdkit
/
Code
/
GraphMol
/
PartialCharges
History
Greg Landrum
ec31bea97b
clang-tidy-7 pass (
#2408
)
2019-04-16 12:05:47 -04:00
..
Wrap
Remove a bunch of Python2-related warts (
#2315
)
2019-03-06 20:43:49 -05:00
CMakeLists.txt
- enable building DLLs on Windows (
#1861
)
2018-05-16 08:42:41 +02:00
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