rdkit

mirror of https://github.com/rdkit/rdkit.git synced 2026-06-04 21:54:27 +08:00

Files

Eisuke Kawashima b53ee20b49 Fix Flake8 erorrs (#4252 )

* Fix PEP8 [E101](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [E502](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [E703](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [E711](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [E712](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [E713](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [E722](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

* Fix PEP8 [W605](https://github.com/PyCQA/pycodestyle/blob/2.8.0/docs/intro.rst#error-codes)

2022-03-10 06:55:18 +01:00

test_data

fixes #4302 (#4303 )

2021-07-10 05:06:25 +02:00

testExecs

Unset executable flag

2019-10-10 20:18:43 +09:00

Wrap

Fix Flake8 erorrs (#4252 )

2022-03-10 06:55:18 +01:00

CMakeLists.txt

switch to using target_compile_definitions instead of add_definitions (#3350 )

2020-08-21 04:49:07 +02:00

MolTransforms.cpp

cleanup some compiler warnings (#4521 )

2021-09-16 04:34:40 +02:00

MolTransforms.h

a few doxygen comment fixes (#4368 )

2021-08-09 04:58:01 +02:00

ReadMe

Unset executable flag

2019-10-10 20:18:43 +09:00

test1.cpp

fixes #4302 (#4303 )

2021-07-10 05:06:25 +02:00

ReadMe

These are files for doing geometric transformations (rotation,
scaling, etc.) on molecules.