REL: Prepare for the Auto-FOX 1.0.0b1 release

nlesc-nano · May 9, 2023 · 5493c7e · 5493c7e
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diff --git a/CHANGELOG.rst b/CHANGELOG.rst
@@ -8,7 +8,13 @@ This project adheres to `Semantic Versioning <http://semver.org/>`_.
 
 1.0.0
 *****
-* *Placeholder*.
+* Bump the minimum nano-utils version
+* Issue a warning in the psf recipe if the qd or ligands don't have any bonds
+* Fix an issue with parsing multiple ligands in `generate_psf2``
+* Add formal Python 3.11 support
+* Pin pandas to <2.0.0
+* Test using CP2K 2023.1
+* Add a citation.cff file
 
 
 0.10.2

diff --git a/CITATION.cff b/CITATION.cff
@@ -15,9 +15,9 @@ keywords:
  - Workflows
  - forcefield
  - forcefield-parameterization
-version: '0.10.2'
-date-released: "2022-08-31"
+version: '1.0.0b1'
+date-released: "2023-05-09"
 repository-code: https://github.com/nlesc-nano/auto-FOX
-license: "GPL-3.0"
+license: "LGPL-3.0"
 doi: 10.5281/zenodo.3988142
 type: software
diff --git a/FOX/__version__.py b/FOX/__version__.py
@@ -1,3 +1,3 @@
 """The Auto-FOX version."""
 
-__version__ = '1.0.0.dev0'
+__version__ = '1.0.0b1'