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Expand group resources page: consider consolidating external resources/pages that are useful #7
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Some external ideas:
Internal:
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Pat Walters’ practical cheminformatics
Derek Lowe’s in the pipeline
Sent from my phone; please excuse my brevity
…On Tue, Jul 2, 2024 at 01:44 Kevin Yu ***@***.***> wrote:
Some external ideas:
- Andrew White's book: https://dmol.pub/intro.html
- Greg Landrum rdkit blog: https://greglandrum.github.io/rdkit-blog/
- Smarts.plus: https://smarts.plus/
- Distill: https://distill.pub/
- DeepChem:
https://deepchem.io/tutorials/the-basic-tools-of-the-deep-life-sciences/
Internal:
- ML4MolEng sets: https://github.com/coleygroup/ML4MolEng
- OpenRetro
- MolScribe / RxnScribe / OpenChemIE
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I am a fan of awesome lists for gathering resources on and off GitHub and once created one for digital chemistry here: https://github.com/mlederbauer/awesome-learning-digital-chemistry Potentially some of the tutorials referenced there – VolkamerLab Talktorials on CADD, Transformers for Chemistry and Materials Science, Practical Programming etc. could be useful to mention |
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