Indigo 1.13.0

Released 2023-10-04

What’s Changed

Bugfixes

  • #1205 Reagent located at the bottom of the arrow when opening the RXN V2000 and V3000 files are located on top of the arrow

  • #1168 Error message when trying to save structure with Multiple Group type applied to entire structure

  • #1166 CDX: file with R-Group label saved in Ketcher opens without part of structure

  • #1159 [CDX] IndigoException: stoi when reading USPTO CDX file

  • #1155 [CDX] Indigo header files doesn’t appear in msvc solution.

  • #1152 No module named tzdata while running indigo service

  • #1139 core dumped when reading CDX file downloaded from USPTO

  • #1113 RXN 3000 import: When importing, the structure becomes unreadable

  • #1094 Structure with R-Group isn’t opened correctly from v3000 mol file

  • #1061 [Bingo-Elastic] Cannot create custom index in python bingo-elastic

  • #1026 [Bingo-Elastic] SVG/PNG: Contracted ‘Functional Groups’ and ‘Salts and Solvents’ are rendered expanded when saved

  • #926 CDXML import: ‘superscript’ and ‘subscript’ appears below the letter

Features

  • #1182 Enhanced stereo labels on atropisomers are lost when opening molfiles

  • #1158 Ketcher needs to correctly serialize/deserialize attachment point information for super atoms for mol v3000 & ket format

Improvements

  • #1111 api: add method for copying RGroups for Java and .NET

  • #1124 SMILES format does not store alias information

Full Changelog: https://github.com/epam/Indigo/compare/indigo-1.12.0…indigo-1.13.0