Prepare first release

Remove TODO

README.md

@@ -65,17 +65,6 @@ pytest -v  # discover and run all tests
 
 See the [developer guide](http://aiida-dataframe.readthedocs.io/en/latest/developer_guide/index.html) for more information.
 
-## TODO:
-
-- Add calcfunctions for common DataFrame operations to track provenance
-  - groupby
-  - ...
-- Large DataFrames might be better stored in the file repository
-  - Investigate performance of different file serializations
-  - Keep two Data classes to let users choose where to store the data?
-- Should the `df` property have a setter to mutate the DataFrame?
-  - Raise when the node is already stored
-
 ## License
 
 MIT

aiida_dataframe/__init__.py

@@ -4,4 +4,4 @@
 AiiDA data plugin for pandas DataFrame objects
 """
 
-__version__ = "0.1.0a0"
+__version__ = "0.1.0"

pyproject.toml

@@ -16,7 +16,12 @@ classifiers = [
     "Intended Audience :: Science/Research",
     "License :: OSI Approved :: MIT License",
     "Natural Language :: English",
-    "Development Status :: 3 - Alpha",
+    'Development Status :: 4 - Beta',
+    'Programming Language :: Python :: 3',
+    'Programming Language :: Python :: 3.7',
+    'Programming Language :: Python :: 3.8',
+    'Programming Language :: Python :: 3.9',
+    'Programming Language :: Python :: 3.10',
     "Framework :: AiiDA"
 ]
 keywords = ["aiida", "plugin"]
@@ -30,6 +35,8 @@ dependencies = [
 
 [project.urls]
 Source = "https://github.com/janssenhenning/aiida-dataframe"
+Home = "https://aiida-dataframe.readthedocs.io"
+Documentation = "https://aiida-dataframe.readthedocs.io"
 
 [project.optional-dependencies]
 testing = [