https://github.com/fxcoudert/binders
This repository contains some Python binders for teaching, by François-Xavier Coudert
https://github.com/fxcoudert/binders
chemistry machine-learning materials-science teaching-materials
Last synced: about 2 months ago
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This repository contains some Python binders for teaching, by François-Xavier Coudert
- Host: GitHub
- URL: https://github.com/fxcoudert/binders
- Owner: fxcoudert
- Created: 2021-09-17T10:02:35.000Z (almost 4 years ago)
- Default Branch: master
- Last Pushed: 2025-02-06T13:48:08.000Z (4 months ago)
- Last Synced: 2025-04-30T17:03:23.398Z (about 2 months ago)
- Topics: chemistry, machine-learning, materials-science, teaching-materials
- Language: Jupyter Notebook
- Homepage: https://www.coudert.name
- Size: 13.6 MB
- Stars: 1
- Watchers: 3
- Forks: 3
- Open Issues: 0
-
Metadata Files:
- Readme: README.md
Awesome Lists containing this project
README
# Python binders
[](https://mybinder.org/v2/gh/fxcoudert/binders/HEAD)
This repository contains some Python binders for teaching.
## Test
- [Simple notebook for testing that Binder works](https://mybinder.org/v2/gh/fxcoudert/binders/HEAD?urlpath=lab/tree/test.ipynb)
## Machine learning in chemistry
- Prediction of melting point of organic molecules by linear regression: [view/read](https://nbviewer.org/github/fxcoudert/binders/blob/master/projects/Linear_regression_melting_point.ipynb) or [run in your browser](https://mybinder.org/v2/gh/fxcoudert/binders/HEAD?urlpath=lab/tree/projects/Linear_regression_melting_point.ipynb)
- Classification of molecules by aqueous solubility: [view/read](https://nbviewer.org/github/fxcoudert/binders/blob/master/projects/Classification_soluble_molecules.ipynb) or [run in your browser](https://mybinder.org/v2/gh/fxcoudert/binders/HEAD?urlpath=lab/tree/projects/Classification_soluble_molecules.ipynb)
- Similarity of molecules in a dataset: [view/read](https://nbviewer.org/github/fxcoudert/binders/blob/master/projects/Similarity_of_molecules.ipynb) or [run in your browser](https://mybinder.org/v2/gh/fxcoudert/binders/HEAD?urlpath=lab/tree/projects/Similarity_of_molecules.ipynb)
- Predicting 13C NMR shifts of organic molecules: [view/read](https://nbviewer.org/github/fxcoudert/binders/blob/master/projects/NMR_prediction.ipynb) or [run in your browser](https://mybinder.org/v2/gh/fxcoudert/binders/master?filepath=projects/NMR_prediction.ipynb)