Greg Landrum 9214d4becb Support Python 3.11 (#5994) ...

* remove some more deprecated numpy stuff

* workaround for changes to random.shuffle in python 3.11

* fix pickling of rdkit mols in python 3.11

* add py311 build to CI

* update py311 CI

* remove qt for py311 for the moment

* only use the new code with pyversion >=3.11

* use the new logic for all pickle_suites

* need to work with older py too

2023-02-23 05:01:12 +01:00

..

Catalogs

small changes to get the RDKit to build with C++20 (#5581)

2022-09-21 16:36:24 +02:00

ChemicalFeatures

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

cmake

Fix invocation of pytest (#5703)

2022-11-23 06:22:09 +01:00

DataManip

Run clang-format against cpp (#4358)

2021-10-20 04:25:27 +02:00

DataStructs

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

Demos

Run clang-format against cpp (#4358)

2021-10-20 04:25:27 +02:00

DistGeom

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

doxygen

update doxygen files and add new logo without text

2013-07-11 07:19:33 +02:00

Features

Run clang-format against header files (#4143)

2021-06-08 07:57:51 +02:00

ForceField

fix doxygen comments (#5254)

2022-07-11 13:55:35 +02:00

Fuzz

Run clang-format against cpp (#4358)

2021-10-20 04:25:27 +02:00

Geometry

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

GraphMol

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

JavaWrappers

Fixes #5704 (#5705)

2022-11-23 06:29:01 +01:00

MinimalLib

Tiny change to get demo.html to load in legacy browsers (#5964)

2023-02-06 17:03:03 +01:00

ML

Run clang-tidy (readability-braces-around-statements) (#4977)

2022-03-10 08:00:10 +01:00

Numerics

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

PgSQL/rdkit

Fixes #5734 (#5875)

2023-02-23 04:59:30 +01:00

Query

clang-tidy: readability-simplify-boolean-expr (#4639)

2022-03-17 13:50:50 +01:00

RDBoost

Support Python 3.11 (#5994)

2023-02-23 05:01:12 +01:00

RDGeneral

Remove dependency on MSVC runtime DLL in MinGW builds as it is not needed anymore (#5800)

2022-12-08 06:11:35 +01:00

RDStreams

switch to using target_compile_definitions instead of add_definitions (#3350)

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

SimDivPickers

Fixes #5210 (#5408)

2022-07-11 11:20:03 +02:00

CMakeLists.txt

MinimalLib: add CFFI interface (#4018)

2021-04-15 21:33:52 +02:00

notes.txt

Unset executable flag

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