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New SEAMM package database
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0. seamm changed from 2024.11.3 to 2024.11.29
1. read-structure-step changed from 2024.11.13 to 2024.11.29
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GitHub Action committed Nov 30, 2024
1 parent 136bc6a commit f359c64
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Showing 2 changed files with 6 additions and 6 deletions.
8 changes: 4 additions & 4 deletions environments/SEAMM_packages.json
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{
"conceptdoi": "10.5281/zenodo.7789853",
"date": "2024-11-28T05:41:48.165685+00:00",
"doi": "10.5281/zenodo.14233549",
"date": "2024-11-30T05:39:35.399661+00:00",
"doi": "10.5281/zenodo.14249269",
"packages": {
"control-parameters-step": {
"channel": "pypi",
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"channel": "pypi",
"description": "A SEAMM plug-in to read common formats in computational chemistry",
"type": "MolSSI plug-in",
"version": "2024.11.13"
"version": "2024.11.29"
},
"reference-handler": {
"channel": "conda-forge",
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"channel": "conda-forge",
"description": "The core of the SEAMM environment and graphical interface.",
"type": "Core package",
"version": "2024.11.3"
"version": "2024.11.29"
},
"seamm-ase": {
"channel": "pypi",
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4 changes: 2 additions & 2 deletions environments/seamm_pinned.yml
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Expand Up @@ -18,7 +18,7 @@ dependencies:
# Core packages
- molsystem==2024.11.27.1
- reference-handler==0.9.1
- seamm==2024.11.3
- seamm==2024.11.29
- seamm-dashboard==2024.6.2
- seamm-datastore==2024.6.2
- seamm-ff-util==2024.6.27
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- qcarchive-step==2023.3.30
- quickmin-step==2024.5.7
- rdkit-step==2023.2.22
- read-structure-step==2024.11.13
- read-structure-step==2024.11.29
- set-cell-step==2021.10.14
- strain-step==2022.11.7
- supercell-step==2023.11.5
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