29 September 2026 – Macs in Chemistry

Safari Extension

This a Safari Extension, it allows you so select a drug name in a web page (for example), right-click and from the dropdown menu there

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@macinchem.bsky.social 5 days

AlvaSketcher has been updated to include R-group support macinchem.org/2026/09/12/a...
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@macinchem.bsky.social 6 days

mlxmolkit updated

mlxmolkit is a GPU-accelerated molecular toolkit using MLX on Apple Silicon, it is a port of nvMolKit that uses Cuda. It now includes AreaWhat it doesEntry pointConformersDrop-in for RDKit EmbedMolecules:...

https://macinchem.org/2026/09/23/mlxmolkit-updated-2/
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@macinchem.bsky.social 1 week

ChemDoodle Update

ChemDoodle 2D has been updated. The main focus is expanded support for inorganic compounds and complexes, including haptic bonds and multi-center attachments, their use in formula and mass calculations,...

https://macinchem.org/2026/09/20/chemdoodle-update/
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@macinchem.bsky.social 2 weeks

AlvaSketcher

There a number of chemical drawing packages around that range from lightweight apps for providing structure input to database searches to large fully features packages designed to provide publication...
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@macinchem.bsky.social 3 weeks

dock-postprocess

This looks very useful. dock-postprocess is an open-source structure-based drug design toolkit for standardizing docking results and carrying them through restrained OpenMM minimization, pose QC, protein-ligand...

https://macinchem.org/2026/09/07/dock-postprocess/

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