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VMD: 1.9.4a57 (GH200)#192

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albestro wants to merge 19 commits intoeth-cscs:maineth-cscs/alps-uenv:mainfrom albestro:alby/vmd-gh200albestro/alps-uenv:alby/vmd-gh200Copy head branch name to clipboard

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Commits

Commits on Feb 21, 2025

• vmd: starting point for a recipe

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  42db333

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• introduce vmd to ci

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  65a0a81

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• fix wrong path to vmd artifact in jfrog

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  19159ae

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• activate bash options trying to improve error reporting

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  e0b08e1

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• fix environment variables

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• make post-install script verbose

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Commits on Feb 24, 2025

• put activation script in uenv mount point

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• more detailed description

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• fix activation script

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• drop mpi part for the moment

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• tcl and tk are both root specs

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• export also compilers in develop view

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  f8d8a1c

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Commits on Feb 25, 2025

• cleanup

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  1b4ed9b

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• try using develop view in post-install

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  688dc8c

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• TEST: create a vmd view so that can be "adjusted" for usage in post-install

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  f400858

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• start migrating to custom vmd spack package

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Commits on Feb 26, 2025

• rename view to default

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  f3c3281

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• treat cuda as a variant

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  678b04e

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• add current constraints for vmd package spack recipe

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