kuelumbus/rdkit-pypi

Issues

• bad_alloc was found while trying to load Chem moduel in with Python import

  #112 opened a month ago by Kh4L
  4

• Important modules missing from latest RDKit version on pip

  #109 opened 2 months ago by Gondone123
  2

• no YAeHMOP support on Mac ARM for rdkit 2023.05

  #96 opened 2 months ago by juius
  3

• Patch versions of `2024.03` are missing at PyPI

  #103 opened 2 months ago by padix-key
  3

• Wheels for pyodide/pyscript

  #81 opened a year ago by churnikov
  9

• Python stubs are missing for Windows wheels

  #98 opened 3 months ago by kuelumbus
  1

• Incompatible with NumPy 2

  #102 opened 3 months ago by njzjz
  0

• Missing wheels on PyPI due to size limit for RDKit versions larger than 2023.9.6

  #99 opened 3 months ago by kuelumbus
  2

• Latest version not on pypi

  #92 opened 7 months ago by guyrosin
  5

• `rdkit.rdBase.boostVersion` is empty string in latest release installed from PyPI using pip

  #88 opened 9 months ago by radusuciu
  2

• ERROR: 132

  #35 opened a year ago by curcioriccardo
  15

• Installation on raspberry pi bullseye failed

  #76 opened a year ago by kovalp
  12

• Missing/invalid X11 libraries dependencies for libcairo on GNU/Linux

  #75 opened 2 years ago by grgi
  4

• Version mismatch due to setuptools cutting trailing zeros?

  #74 opened 2 years ago by j3mdamas
  2

• Musl linux wheels are missing

  #72 opened 2 years ago by foxbunny
  4

• libXrender.so.1 not available

  #71 opened 2 years ago by plbremer
  1

• Set upper bound for numpy version

  #69 opened 2 years ago by a-r-j
  2

• Python 3.11 support on PyPI comes with RDKit release 2022.9.2

  #66 opened 2 years ago by gedeck
  3

• SystemError: initialization of rdchem raised unreported exception

  #65 opened 2 years ago by clefourrier
  5

• PyPI Release for 3.11 support

  #64 opened 2 years ago by a-r-j
  2

• Turn on RDK_BUILD_XYZ2MOL_SUPPORT

  #62 opened 2 years ago by jhjensen2
  4

• Python 3.11 wheels

  #55 opened 2 years ago by kuelumbus
  0

• `Contrib` folder missing

  #51 opened 2 years ago by ale94mleon
  5

• Update repo about

  #49 opened 2 years ago by stsouko
  1

• Rename rdkit-pypi to rdkit; avoid conflicts with conda

  #48 opened 2 years ago by skearnes
  14

• ImportError: No module named rdkit

  #46 opened 2 years ago by sophialeeman
  3

• cannot import name 'rdFreeSASA' from 'rdkit.Chem'

  #43 opened 2 years ago by sfias
  1

• cibuildwheel fails on dev laptop due to use of CIBW_BUILD in setup.py

  #42 opened 2 years ago by sconstable
  5

• No Mac M1 wheels for `<2021.9.4`

  #41 opened 2 years ago by nlarusstone
  8

• RDKit-PyPi Numpy >= 1.19 Dependency

  #38 opened 2 years ago by amirnikooie
  4

• Linux aarch64 wheels

  #24 opened 3 years ago by kuelumbus
  6

• Segmentation fault due to corrupt Cairo

  #32 opened 3 years ago by Shahxad-Akram
  8

• MacOS ARM64 platform native wheels for M1 hardware

  #22 opened 3 years ago by sinwoobang
  14

• Python 3.10 builds for Windows

  #17 opened 3 years ago by kuelumbus
  0

• Ensure that the RDKit's data directory and supporting files are installed

  #20 opened 3 years ago by greglandrum
  7

• rdEHTTools missing

  #18 opened 3 years ago by mkrompiec
  2

• Ask for Windows support

  #8 opened 3 years ago by radifar
  14

• installation error on python 3.8.8 rdkit

  #10 opened 3 years ago by quad400
  1

• installation error on python 3.8.8 rdkit

  #11 opened 3 years ago by quad400
  1

• ValueError: BitVects must be same length (rdkit)

  #7 opened 3 years ago by mostafiz67
  2

• Use rdkit Chemical Features

  #6 opened 3 years ago by clarissedescamps
  1

• cannot use rdkit.Chem.MolStandardize.rdMolStandardize.Normalize

  #5 opened 3 years ago by philopon
  2

• add 3D descriptors support

  #4 opened 3 years ago by greglandrum
  2

• MacOS support

  #1 opened 3 years ago by churnikov
  3

• add CAIRO_SUPPORT

  #2 opened 3 years ago by skalinin
  6