diff --git a/environments/SEAMM_packages.json b/environments/SEAMM_packages.json index 225ec08..016c4e6 100644 --- a/environments/SEAMM_packages.json +++ b/environments/SEAMM_packages.json @@ -1,7 +1,7 @@ { "conceptdoi": "10.5281/zenodo.7789853", - "date": "2024-07-26T05:34:20.589357+00:00", - "doi": "10.5281/zenodo.12890258", + "date": "2024-07-28T05:34:57.034292+00:00", + "doi": "10.5281/zenodo.13118054", "packages": { "control-parameters-step": { "channel": "pypi", @@ -61,7 +61,7 @@ "channel": "pypi", "description": "A SEAMM plugin for A SEAMM plug-in for Gaussian", "type": "MolSSI plug-in", - "version": "2024.6.5" + "version": "2024.7.27" }, "geometry-analysis-step": { "channel": "pypi", @@ -142,7 +142,7 @@ "version": "2023.11.16" }, "reference-handler": { - "channel": "conda-forge", + "channel": "pypi", "description": "no description given", "type": "Core package", "version": "0.9.1" diff --git a/environments/seamm.yml b/environments/seamm.yml index 512f237..6d2825d 100644 --- a/environments/seamm.yml +++ b/environments/seamm.yml @@ -15,7 +15,6 @@ dependencies: - qcportal - molsystem - - reference-handler - seamm - seamm-dashboard - seamm-datastore @@ -31,6 +30,7 @@ dependencies: # PyPi packages - pip: # Core packages + - reference-handler - seamm-exec - seamm-jobserver diff --git a/environments/seamm_pinned.yml b/environments/seamm_pinned.yml index 6e7c9b6..cdb7335 100644 --- a/environments/seamm_pinned.yml +++ b/environments/seamm_pinned.yml @@ -17,7 +17,6 @@ dependencies: # Core packages - molsystem==2024.6.21 - - reference-handler==0.9.1 - seamm==2024.7.21 - seamm-dashboard==2024.6.2 - seamm-datastore==2024.6.2 @@ -33,6 +32,7 @@ dependencies: # PyPi packages - pip: # Core packages + - reference-handler==0.9.1 - seamm-exec==2024.7.25 - seamm-jobserver==2024.3.12 @@ -46,7 +46,7 @@ dependencies: - fhi-aims-step==2024.1.19 - forcefield-step==2024.6.30 - from-smiles-step==2023.11.10 - - gaussian-step==2024.6.5 + - gaussian-step==2024.7.27 - geometry-analysis-step==2023.1.14 - lammps-step==2024.7.25 - loop-step==2023.11.9