diff --git a/chemicaltoolbox/silicos-it/qed/silicos_qed.xml b/chemicaltoolbox/silicos-it/qed/silicos_qed.xml index 9b768d42b6..e94fb86cc7 100644 --- a/chemicaltoolbox/silicos-it/qed/silicos_qed.xml +++ b/chemicaltoolbox/silicos-it/qed/silicos_qed.xml @@ -1,6 +1,6 @@ - 2021.03.4 + 2024.09.1 0 quantitative estimation (QED) with RDKit