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New SEAMM package database
0. gaussian-step changed from 2024.1.19 to 2024.5.8
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environments/SEAMM_packages.json

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{
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"conceptdoi": "10.5281/zenodo.7789853",
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"date": "2024-05-09T05:34:36.216622+00:00",
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"doi": "10.5281/zenodo.11158816",
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"date": "2024-05-10T05:33:52.817253+00:00",
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"doi": "10.5281/zenodo.11171015",
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"packages": {
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"control-parameters-step": {
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"channel": "pypi",
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"channel": "pypi",
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"description": "A SEAMM plugin for A SEAMM plug-in for Gaussian",
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"type": "MolSSI plug-in",
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"version": "2024.1.19"
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"version": "2024.5.8"
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},
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"geometry-analysis-step": {
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"channel": "pypi",

environments/seamm_pinned.yml

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- fhi-aims-step==2024.1.19
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- forcefield-step==2024.1.10
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- from-smiles-step==2023.11.10
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- gaussian-step==2024.1.19
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- gaussian-step==2024.5.8
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- geometry-analysis-step==2023.1.14
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- lammps-step==2024.3.22
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- loop-step==2023.11.9

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