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Day: 17 November 2023

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Hints and Tutorials Uncategorised

Psi4 on Apple Silicon

17 November 202317 November 2023 chris

A couple of folks have asked about the availability of Psi4 on Apple Silicon From Wikipedia Psi is an ab initio computational chemistry package originally written by the research

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Avatar Chris Swain @macinchem ·
6h

An AutoDock Vina script https://macinchem.org/2023/12/08/an-autodock-vina-script/ #rdkit #cheminformatics #compchem #docking

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Avatar Patrick Walters @wpwalters ·
24h

New post at Practical Cheminformatics, “Some Thoughts on Biotech vs Pharma for Computational Chemists”. https://practicalcheminformatics.blogspot.com/2023/12/some-thoughts-on-biotech-vs-pharma-for.html

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Avatar Chris Swain @macinchem ·
6 Dec

Using RDKit MolsMatrixToGridImage https://macinchem.org/2023/12/06/rdkit-molsmatrixtogridimagerdkit/ #cheminformatics #rdkit

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Avatar Chris Swain @macinchem ·
4 Dec

Chemcraft in beta for Mac ARM and Mac Intel https://macinchem.org/2023/12/04/chemcraft-for-in-beta-for-mac-arm-and-mac-intel/ #compchem
#applesilicon

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