From 50c362a8eb54e9ebff36ca0a83e056f533ef7668 Mon Sep 17 00:00:00 2001 From: "Christian W. Feldmann" <128160984+c-w-feldmann@users.noreply.github.com> Date: Thu, 17 Oct 2024 10:37:14 +0200 Subject: [PATCH 1/2] Update requirements_chemprop to 2.0.5 --- requirements_chemprop.txt | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/requirements_chemprop.txt b/requirements_chemprop.txt index 57b62453..ed31e961 100644 --- a/requirements_chemprop.txt +++ b/requirements_chemprop.txt @@ -1,2 +1,2 @@ -chemprop >=2.0.3, <=2.0.4 +chemprop >=2.0.3, <=2.0.5 lightning From 73e08f9339c6981c1686e780df9488b2faffd4d9 Mon Sep 17 00:00:00 2001 From: Christian Feldmann Date: Mon, 30 Jun 2025 14:58:43 +0200 Subject: [PATCH 2/2] require chemprop==2.2.0 --- pyproject.toml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index 2eb94220..f0ce021f 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -27,7 +27,7 @@ dependencies = [ [project.optional-dependencies] chemprop = [ - "chemprop>=2.0.3,<=2.0.4", + "chemprop>=2.2.0,<=2.0.0", "lightning>=2.5.1", ] notebooks = [