nrflynn2 / ml-drug-discovery
The official repository for the book "Machine Learning for Drug Discovery" (Manning Publications)
Why this job: works in the areas we cover, but does not say which job it does
What it does
This repository contains code and data for Build AI Drug Discovery Pipelines (Manning Publications). The companion material within this repository covers introductory topics at the intersection of machine learning, deep learning, and drug discovery applied to real world scenarios in each chapter. The code and notebooks are released under the Apache 2.0 license.
Get started
No single install command. Read the steps in the README (opens in new tab)
- Maintenance
- Active
- Last commit 3 months ago
- Stars
- 121
- +1 this week
- Licence
- Apache-2.0
- Allows business use
- Downloads for
- None listed
- No release files
- Latest version
- None yet
- No releases
- Built with
- Jupyter Notebook
- 99% of the code
Is it looked after?
- Contributors
- Not stated
- Last 90 days
- Issues
- 100% closed
- 0 still open
- Pull requests
- 23 merged
- 1 waiting
- Releases
- None
- Never published
- No contributing guide
- No security policy
- No code of conduct
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More: languages, topics and project record
Languages
- Jupyter Notebook 99%
- Python 1%
- Just <1%
- Shell <1%
Topics
- ai
- cheminformatics
- deep-learning
- drug-discovery
- machine-learning
- medicinal-chemistry
- medicine-applications
- notebooks
- python
- pytorch
Project record
- JobOther AI tools
- StatusListed
- Commits125
- Forks36
- Watching6
- Stars in 28 days+11
- CreatedJul 10, 2023
- First seen by usNov 7, 2026
- CheckedNov 8, 2026