Release Version 0.5.1

.github/workflows/CI.yaml

@@ -11,7 +11,7 @@ jobs:
     runs-on: ubuntu-latest
     strategy:
       matrix:
-        pixi-env: ["py311", "py312", "py313", "py314"]
+        pixi-env: ["py310", "py311", "py312", "py313", "py314"]
 
     steps:
       - uses: actions/checkout@8e8c483db84b4bee98b60c0593521ed34d9990e8 # v6

.readthedocs.yaml

@@ -9,7 +9,7 @@ version: 2
 build:
   os: ubuntu-20.04
   tools:
-    python: "3.9"
+    python: "3.10"
 
 # Build documentation in the docs/ directory with Sphinx
 sphinx:

.ruff.toml

@@ -1,4 +1,4 @@
-target-version = "py311"
+target-version = "py310"
 line-length = 90
 
 [lint]

docs/source/conf.py

@@ -23,8 +23,8 @@
 author = "Jelena Tosovic, Domagoj Fijan, Marko Jukic, Urban Bren"
 
 # The full version, including alpha/beta/rc tags
-version = "0.5.0"
-release = "0.5.0"
+version = "0.5.1"
+release = "0.5.1"
 
 
 # -- General configuration ---------------------------------------------------

docs/source/installation.rst

@@ -36,13 +36,13 @@ PyMOL plugin installation
 
 This guide provides detailed installation instructions for Linux, Mac,
 and Windows users. We recommend using `conda` or `mamba` to create a new
-environment with at least Python 3.9.
+environment with at least Python 3.10.
 
 Note that PyMOL which can be downloaded from the `PyMOL website
 <https://pymol.org/2/>`_ comes with python 3.7 which is not supported by
 WaterNetworkAnalysis or ConservedWaterSearch. For this reason users
 will have to install `mamba/conda` and create a new environment with
-python version greater or equal to 3.9 and install PyMOL in that environment.
+python version greater or equal to 3.10 and install PyMOL in that environment.
 The plugin has been tested with PyMOL version > 2.5.0.
 
 Prerequisites
@@ -67,7 +67,7 @@ Installation Steps
 
      .. code-block:: bash
 
-        conda create -n myenv python=3.9
+        conda create -n myenv python=3.10
 
    Replace ``myenv`` with your preferred environment name.
 

pixi.toml

@@ -4,21 +4,17 @@ channels = ["conda-forge"]
 platforms = ["linux-64", "osx-64", "osx-arm64", "win-64"]
 
 [dependencies]
-python = ">=3.11,<3.15"
+python = ">=3.10,<3.15"
 pip = "*"
 
 [pypi-dependencies]
-ConservedWaterSearch = ">=0.1.0"
-MDAnalysis = ">=2.4.0"
-numpy = ">=1.22"
-scipy = ">=1.0.0"
+ConservedWaterSearch = "*"
+MDAnalysis = "*"
+numpy = ">=2.0"
+scipy = "*"
 
 [feature.test.pypi-dependencies]
 pytest = "*"
-ConservedWaterSearch = "==0.5.1"
-MDAnalysis = "==2.10.0"
-numpy = "==2.4.1"
-scipy = "==1.17.0"
 
 [feature.lint.pypi-dependencies]
 ruff = "*"
@@ -29,6 +25,9 @@ prek = "*"
 [feature.build.pypi-dependencies]
 build = "*"
 
+[feature.py310.dependencies]
+python = "3.10.*"
+
 [feature.py311.dependencies]
 python = "3.11.*"
 
@@ -42,6 +41,7 @@ python = "3.13.*"
 python = "3.14.*"
 
 [environments]
+py310 = { features = ["py310", "test"] }
 py311 = { features = ["py311", "test"] }
 py312 = { features = ["py312", "test"] }
 py313 = { features = ["py313", "test"] }

pyproject.toml

@@ -30,8 +30,9 @@ classifiers = [
     "Programming Language :: Python :: 3.12",
     "Programming Language :: Python :: 3.13",
     "Programming Language :: Python :: 3.14",
+    "Programming Language :: Python :: 3.10",
 ]
-requires-python = ">=3.11"
+requires-python = ">=3.10"
 dynamic = ["dependencies"]
 
 [project.urls]

requirements/requirements-test.txt

@@ -1,4 +1,4 @@
-ConservedWaterSearch==0.5.0
+ConservedWaterSearch==0.5.1
 MDAnalysis==2.10.0
 numpy==2.4.1
 scipy==1.17.0

requirements/requirements.txt

@@ -1,4 +1,4 @@
-ConservedWaterSearch>=0.5.0
+ConservedWaterSearch>=0.5.1
 MDAnalysis>=2.4.0
 numpy>=2.0.0
 scipy>=1.0.0