New SEAMM package database

0. seamm changed from 2024.5.1 to 2024.5.3.1
1. quickmin-step changed from 2023.11.15 to 2024.5.3
2. molsystem changed from 2024.4.5 to 2024.5.6

Author: GitHub Action

environments/SEAMM_packages.json

@@ -1,6 +1,7 @@
 {
-    "date": "2024-05-02T05:34:39.454261+00:00",
-    "doi": "10.5281/zenodo.7860696",
+    "conceptdoi": "10.5281/zenodo.7789853",
+    "date": "2024-05-07T09:02:21.032230+00:00",
+    "doi": "10.5281/zenodo.11125178",
     "packages": {
         "control-parameters-step": {
             "channel": "pypi",
@@ -78,7 +79,7 @@
             "channel": "conda-forge",
             "description": "molsystem",
             "type": "Core package",
-            "version": "2024.4.5"
+            "version": "2024.5.6"
         },
         "mopac-step": {
             "channel": "pypi",
@@ -120,7 +121,7 @@
             "channel": "pypi",
             "description": "A SEAMM plug-in for simple, quick minimization",
             "type": "MolSSI plug-in",
-            "version": "2023.11.15"
+            "version": "2024.5.3"
         },
         "rdkit-step": {
             "channel": "pypi",
@@ -144,7 +145,7 @@
             "channel": "conda-forge",
             "description": "The core of the SEAMM environment and graphical interface.",
             "type": "Core package",
-            "version": "2024.5.1"
+            "version": "2024.5.3.1"
         },
         "seamm-dashboard": {
             "channel": "conda-forge",

environments/seamm_pinned.yml

@@ -13,9 +13,9 @@ dependencies:
 
     # Core packages
 
-  - molsystem==2024.4.5
+  - molsystem==2024.5.6
   - reference-handler==0.9.1
-  - seamm==2024.5.1
+  - seamm==2024.5.3.1
   - seamm-dashboard==2024.3.27
   - seamm-datastore==2024.3.13
   - seamm-ff-util==2023.8.27
@@ -51,7 +51,7 @@ dependencies:
     - properties-step==2023.7.31
     - psi4-step==2024.3.17
     - qcarchive-step==2023.3.30
-    - quickmin-step==2023.11.15
+    - quickmin-step==2024.5.3
     - rdkit-step==2023.2.22
     - read-structure-step==2023.11.16
     - set-cell-step==2021.10.14