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Macinchem Blog

Command Line tools updated

6 March 202415 March 2024 chris

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Macinchem Blog Science Apps

ChimeraX updated

16 December 202416 December 2024 chris
Macinchem Blog Science Apps

AlvaDesc updated

12 December 202412 December 2024 chris

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  • ChimeraX updated
  • AlvaDesc updated
  • Using VMD and Gromacs on M4 Macs
  • ShEPhERD: Shape, Electrostatics, and Pharmacophore Explicit Representation Diffusion
  • Vortex script to export multiple workspaces to individual sdf files.
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Avatar Chris Swain @macinchem ·
16 Dec

ChimeraX updated https://macinchem.org/2024/12/16/chimerax-updated-2/

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Avatar Chris Swain @macinchem ·
13 Dec

As many of you know I don't send Christmas cards, instead I give the monies I would have spent to MS Research. Have a great time and a successful New Year. https://www.cambridgemedchemconsulting.com/news/index_files/cebf0a892d50e47258a18516f9846379-568.html

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Avatar Chris Swain @macinchem ·
12 Dec

The ChEMBL-og: Improvements in SureChEMBL's chemistry search and ... https://chembl.blogspot.com/2024/11/improvements-in-surechembls-chemistry.html?spref=tw

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Avatar Chris Swain @macinchem ·
12 Dec

AlvaDesc updated https://macinchem.org/2024/12/12/alvadesc-updated/

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  • Vortex script to export multiple workspaces to individual sdf files.
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