From cf6838db0b680274bb43570761129aac545196a2 Mon Sep 17 00:00:00 2001 From: Mike Henry <11765982+mikemhenry@users.noreply.github.com> Date: Thu, 17 Oct 2024 15:24:11 -0700 Subject: [PATCH 1/2] install openff-interchange 0.4 rc --- environment.yml | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/environment.yml b/environment.yml index a9643c1..c56f52a 100644 --- a/environment.yml +++ b/environment.yml @@ -1,5 +1,6 @@ name: openfe_gromacs channels: + - conda-forge/label/openff-interchange_rc - conda-forge dependencies: - openfe @@ -9,5 +10,4 @@ dependencies: - pytest - pytest-xdist - pytest-cov - - pip: - - git+https://github.com/openforcefield/openff-interchange.git + - openff-interchange =0.4 From ab9431bd642940ab86994b36bd5ee3bb5f1a3350 Mon Sep 17 00:00:00 2001 From: "pre-commit-ci[bot]" <66853113+pre-commit-ci[bot]@users.noreply.github.com> Date: Thu, 17 Oct 2024 22:24:49 +0000 Subject: [PATCH 2/2] [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci --- environment.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/environment.yml b/environment.yml index c56f52a..14576a2 100644 --- a/environment.yml +++ b/environment.yml @@ -1,6 +1,6 @@ name: openfe_gromacs channels: - - conda-forge/label/openff-interchange_rc + - conda-forge/label/openff-interchange_rc - conda-forge dependencies: - openfe