From 6b810037570ecd3d7a025ef566b7328705e44962 Mon Sep 17 00:00:00 2001 From: Gabriel Studer <gabriel.studer@unibas.ch> Date: Thu, 19 Dec 2024 11:46:21 +0100 Subject: [PATCH] update CHANGELOG --- CHANGELOG.txt | 12 ++++++++++++ 1 file changed, 12 insertions(+) diff --git a/CHANGELOG.txt b/CHANGELOG.txt index f5ed1821e..5ff5e61a9 100644 --- a/CHANGELOG.txt +++ b/CHANGELOG.txt @@ -1,3 +1,15 @@ +Changes in Release 2.9.1 +-------------------------------------------------------------------------------- + + * Enhanced structure cleanup in ligand scoring to avoid issues when non- + standard atoms are present in reference/ model structures. Cleanup is logged + and available as output in the compare-ligand-structures action. + * Disabled automatic ligand extraction from PDB files. For mmCIF this is still + possible and strictly uses the _entity.type item "polymer" to identify + receptor chains and "non-polymer" to identify ligands. + * OMF bugfix: avoid potentially endless loop in OMF parsing + + Changes in Release 2.9.0 -------------------------------------------------------------------------------- -- GitLab