From a70822c84d569148492ef28df8ab0d36206e855b Mon Sep 17 00:00:00 2001
From: Valerij Talagayev <82884038+talagayev@users.noreply.github.com>
Date: Mon, 2 Sep 2024 14:37:48 +0200
Subject: [PATCH 1/2] Update environment.yml

---
 environment.yml | 1 -
 1 file changed, 1 deletion(-)

diff --git a/environment.yml b/environment.yml
index cadb22ce..826ac4b1 100644
--- a/environment.yml
+++ b/environment.yml
@@ -4,7 +4,6 @@ channels:
   - conda-forge  # Add the conda-forge channel here
 
 dependencies:
-  - python=3.10
   - pip
   - setuptools>=61.0
   - versioningit~=2.0

From 6a7d2489e830caa908d4ee7699167b9ea576d4f1 Mon Sep 17 00:00:00 2001
From: Valerij Talagayev <82884038+talagayev@users.noreply.github.com>
Date: Mon, 2 Sep 2024 14:41:18 +0200
Subject: [PATCH 2/2] Update environment.yml

---
 environment.yml | 16 ++++++++--------
 1 file changed, 8 insertions(+), 8 deletions(-)

diff --git a/environment.yml b/environment.yml
index 826ac4b1..b4961124 100644
--- a/environment.yml
+++ b/environment.yml
@@ -9,21 +9,21 @@ dependencies:
   - versioningit~=2.0
   - pytest>=6.1.2
   - pytest-runner
-  - numpy=1.26.4
-  - plip=2.3.0
+  - numpy
+  - plip
   - requests>=2.28.1
   - rdkit>=2022.03.5
-  - mdtraj=1.9.7
-  - pdbfixer=1.8.1
-  - openff-toolkit=0.16.0
-  - openmmforcefields=0.11.2
+  - mdtraj
+  - pdbfixer
+  - openff-toolkit
+  - openmmforcefields
   - cudatoolkit>=11.7.0
   - cuda-python>=11.7.1
   - mdanalysis>=2.3.0
   - pytest-shutil>=1.7.0
   - flask>=2.2.2
-  - cairosvg=2.7.1
-  - nglview=3.0.6
+  - cairosvg
+  - nglview
   - numba>=0.59.1
   - jupyter
   # Add any additional runtime dependencies from pyproject.toml here