Ricardo Rodriguez
7b7a8a4e17
Refactor iostreams includes ( #8846 )
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* refactor iostreams includes
* restore ostream to MonomerInfo.cpp
2025-10-08 16:08:01 +02:00
Ric
880a8e5725
Reformat Python code for 2023.03 release ( #6294 )
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* run yapf
* run isort
---------
Co-authored-by: Greg Landrum <greg.landrum@gmail.com >
2023-04-28 06:53:56 +02:00
Ric
58d135a874
Reformat C/C++ code ahead of 2023.03 release ( #6295 )
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* format files
* format template files too
2023-04-28 04:42:35 +02:00
Ric
703fe5a225
Remove boost::foreach from public headers ( #3820 )
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* remove include from headers
* update implementation files
* completely remove BOOST_FOREACH (#7 )
* convert those changes to use auto
* get rid of all usage of BOOST_FOREACH
Co-authored-by: Greg Landrum <greg.landrum@gmail.com >
2021-02-17 14:15:48 +01:00
Eisuke Kawashima
75f03412ef
Modernize deprecated header inclusion ( #3137 )
2020-05-04 10:40:57 +02:00
Eisuke Kawashima
9d10c7c4b7
Change line ending from CR+LF to LF [ci skip]
2019-10-21 11:39:25 +09:00
Eisuke Kawashima
185ec927ab
Unset executable flag
2019-10-10 20:18:43 +09:00
Ric
91008ff11d
Address compile warnings & trivial improvements ( #2097 )
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* Address compile warnings & trivial improvements
* revert unwanted initializers; use RDUNUSED_PARAM for unused params
* revert fix in testRDFcustom; marked with 'TO DO' comment
2018-10-12 06:39:32 -04:00
gedeck
e9af48ffd7
Issue1071/yapf ( #1078 )
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* Issue #1071 : add yapf configuration file
* yapf formatting of Code directory
* yapf formatting of Contrib directory
* yapf formatting of Data directory
* yapf formatting of Docs directory
* yapf formatting of External directory
* yapf formatting of Projects directory
* yapf formatting of Regress directory
* yapf formatting of Scripts directory
* yapf formatting of Web directory
* yapf formatting of rdkit directory
2016-09-23 04:58:46 +02:00
Greg Landrum
ad7c54aec7
first-pass python implementation of this
2015-12-02 17:43:24 +01:00
Greg Landrum
ed5e78ff21
add an RDKit implementation of the Plane of Best Fit algorithm
2012-11-17 03:57:07 +00:00
