AIDD_RDKit_Tutorial_2021

Materials from the Intro to the RDKit tutorial at AIDD 2021

OTHER License

Stars
14
View Code on GitHub
Ecosystems: Jupyter Notebook

Statistics for this project are still being loaded, please check back later.

Badges
Extracted from project README
Binder
Related Projects
rdkit-blog

RDKit blog

16 Dec 2022 5
hacking-dask

"Hacking Dask" tutorial materials

25 Mar 2021 70
VQE

Variational Quantum Eigensolver (VQE) from scratch on molecular hydrogen

13 Aug 2020 13
dask-binder-template

29 Aug 2020 5
xskillscore-tutorial

26 Mar 2020 10
euroscipy-2019-scikit-learn-tutorial

17 Jul 2019 29
rdkit-blog-fastpages

30 Dec 2020 19
netcdf

🧮 An introduction to NetCDF

07 Jun 2021 5
scipy2017-jupyter-widgets-tutorial

Notebooks for the SciPy 2017 tutorial "The Jupyter Interactive Widget Ecosystem"

20 Jun 2017 106
notebooks_getting_started

Getting started with GESIS Notebooks

15 Jan 2020 14
pydata-nyc-2018-tutorial

15 Oct 2018 36
RSC_OpenScience_Standardization_202104

Materials for my presentation on molecular standardization as part of the RSC OpenScience worksho...

21 Apr 2021 42
rdkit_blog

RDKit related blog posts, notebooks, and data.

10 Oct 2013 99
R-in-Jupyter-with-Binder

Example of how to use R in Jupyter notebooks and make compatible with Binder

09 Jul 2018 17
aisem23

Repository for the SCS Spring School on Digital Chemistry

16 Mar 2023 18