From 9cd9ae9a630ced0f03600a17f9a38befbba32a2f Mon Sep 17 00:00:00 2001 From: Xavier Robin <xavalias-github@xavier.robin.name> Date: Thu, 10 Aug 2023 10:35:40 +0200 Subject: [PATCH] doc: document end of support for compound libs < 1.5.0 --- CHANGELOG.txt | 6 ++++-- 1 file changed, 4 insertions(+), 2 deletions(-) diff --git a/CHANGELOG.txt b/CHANGELOG.txt index 261ad1c4e..145e431ad 100644 --- a/CHANGELOG.txt +++ b/CHANGELOG.txt @@ -7,8 +7,10 @@ Changes in Release 2.6.0 * Chain mapping updates. Default chain mapping strategy now uses increased sampling - only marginal runtime increase. * The compound library now knows about SMILES strings and atom charges. - Backward compatible with older compound libraries. - * Compound library now reads the "InChI=" part of InChI codes. + Compound libraries created by OST 1.5.0 or later can still be read (SMILES + will be empty and charges set to 0, with a warning). Older files are no + longer supported. + * The compound library now reads the "InChI=" part of InChI codes. * Several bug fixes and improvements. Changes in Release 2.5.0 -- GitLab