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Releases: molssi-seamm/seamm_packaging

2025.3.12: New SEAMM package database

12 Mar 05:23
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2025.3.12
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2025.3.12: New SEAMM package database Latest
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New SEAMM package database

  1. seamm-ff-util changed from 2024.6.27 to 2025.1.21
Assets 2
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2025.3.11: New SEAMM package database

11 Mar 05:23
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2025.3.11
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2025.3.11: New SEAMM package database

New SEAMM package database

  1. seamm-ff-util changed from 2025.1.21 (pypi) to 2024.6.27 (conda-forge)
  2. torchani-step changed from 2025.2.7 to 2025.3.10
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2025.3.10: New SEAMM package database

10 Mar 05:20
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2025.3.10
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2025.3.10: New SEAMM package database

New SEAMM package database

  1. packmol-step changed from 2025.1.29 to 2025.3.9
  2. psi4-step changed from 2024.12.7 to 2025.3.9
  3. seamm-installer changed from 2024.4.22 to 2025.3.9
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2025.3.8: New SEAMM package database

08 Mar 05:19
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2025.3.8
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2025.3.8: New SEAMM package database

New SEAMM package database

  1. dftbplus-step changed from 2025.3.3 to 2025.3.7
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2025.3.7: New SEAMM package database

07 Mar 05:23
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2025.3.7
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2025.3.7: New SEAMM package database

New SEAMM package database

  1. mopac-step changed from 2025.2.23 to 2025.3.6
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2025.3.5: New SEAMM package database

05 Mar 05:24
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2025.3.5
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2025.3.5: New SEAMM package database

New SEAMM package database

  1. geometry-analysis-step changed from 2025.2.9 to 2025.3.4
  2. molsystem changed from 2025.2.23 to 2025.3.4
  3. read-structure-step changed from 2025.1.15 to 2025.3.4
  4. seamm changed from 2025.2.24 to 2025.3.4
  5. subflowchart-step changed from 2024.11.18 to 2025.3.4
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2025.3.3: New SEAMM package database

03 Mar 22:37
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2025.3.3
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2025.3.3: New SEAMM package database

New SEAMM package database

  1. dftbplus-step changed from 2025.2.7 to 2025.3.3
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2024.12.10: New SEAMM package database

10 Dec 16:53
@paulsaxe paulsaxe
2024.12.10
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2024.12.10: New SEAMM package database

New SEAMM package database

  1. gaussian-step changed from 2024.12.1.1 to 2024.12.9
  2. mopac-step changed from 2024.10.15 to 2024.12.9
  3. psi4-step changed from 2024.10.15 to 2024.12.7
  4. read-structure-step changed from 2024.11.29 to 2024.12.7
  5. molsystem changed from 2024.11.27.1 to 2024.12.7
  6. subflowchart-step changed from 3rd-party plug-in to MolSSI plug-in
  7. structure-step changed from 2024.10.24 to 2024.10.20
  8. structure-step changed from 3rd-party plug-in to MolSSI plug-in
  9. seamm-geometric changed from 3rd-party plug-in to Core package
  10. diffusivity-step changed from 2024.7.30.1 to 2024.7.30
  11. crystal-builder-step changed from 2022.7.31 to 2022.8.1
  12. seamm-ff-util changed from 2024.6.27 (conda-forge) to 2024.6.28 (pypi)
  13. seamm-dashboard changed from Core package to 3rd-party plug-in
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2024.12.2: New SEAMM package database

02 Dec 05:41
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2024.12.2
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2024.12.2: New SEAMM package database

New SEAMM package database

  1. gaussian-step changed from 2024.11.18 to 2024.12.1.1
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2024.11.30: New SEAMM package database

30 Nov 05:39
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2024.11.30
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2024.11.30: New SEAMM package database

New SEAMM package database

  1. seamm changed from 2024.11.3 to 2024.11.29
  2. read-structure-step changed from 2024.11.13 to 2024.11.29
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