From 6e5d36a3407d1e5c5c3eb3bd08b20eed5154577f Mon Sep 17 00:00:00 2001 From: Alex Morehead Date: Mon, 12 Aug 2024 17:01:26 -0500 Subject: [PATCH] Upgrade Python docs version to 3.10 --- docs/.docs.environment.yaml | 19 ++++++++++--------- pyproject.toml | 2 +- 2 files changed, 11 insertions(+), 10 deletions(-) diff --git a/docs/.docs.environment.yaml b/docs/.docs.environment.yaml index 7a50523..832d715 100644 --- a/docs/.docs.environment.yaml +++ b/docs/.docs.environment.yaml @@ -9,17 +9,18 @@ channels: - conda-forge dependencies: - openff-amber-ff-ports=0.0.4=pyhca7485f_0 - - openff-forcefields=2023.11.0=pyhca7485f_0 - - openff-interchange=0.3.18=pyhd8ed1ab_0 - - openff-interchange-base=0.3.18=pyhd8ed1ab_0 - - openff-models=0.1.1=pyhca7485f_0 - - openff-toolkit=0.14.5=pyhd8ed1ab_1 - - openff-toolkit-base=0.14.5=pyhd8ed1ab_1 - - openff-units=0.2.1=pyh1a96a4e_0 + - openff-forcefields=2024.04.0=pyhca7485f_0 + - openff-interchange=0.3.27=pyhd8ed1ab_0 + - openff-interchange-base=0.3.27=pyhd8ed1ab_0 + - openff-models=0.1.2=pyhca7485f_0 + - openff-toolkit=0.16.0=pyhd8ed1ab_1 + - openff-toolkit-base=0.16.0=pyhd8ed1ab_1 + - openff-units=0.2.2=pyhca7485f_0 - openff-utilities=0.1.12=pyhd8ed1ab_0 - - openmm=8.1.0=py39he81762f_1 - - openmmforcefields=0.11.2=pyhd8ed1ab_1 + - openmm=8.1.1=py310h43b6314_1 + - openmmforcefields=0.12.0=pyhd8ed1ab_0 - pdbfixer=1.9=pyh1a96a4e_0 + - python=3.10.14=hd12c33a_0_cpython - pip: - beartype - biopandas diff --git a/pyproject.toml b/pyproject.toml index ac1fc29..28ad598 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -33,7 +33,7 @@ classifiers=[ dependencies = [ # --------- pytorch --------- # "lightning>=2.1.3", - "torch==2.3.0", + "torch>=2.3.0", "torchmetrics>=1.2.0", "torchvision>=0.18.0",