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Automate generation of ANTLR parser files

Status: Open.

#109 In TUCAN-nest/TUCAN;

· JanCBrammer opened on Feb 24, 2023

Add changelog

Status: Open.

#105 In TUCAN-nest/TUCAN;

· JanCBrammer opened on Jan 13, 2023

Improve workflow for CSD database test

dataset

feature

Status: Open.

#103 In TUCAN-nest/TUCAN;

· schatzsc opened on Jan 12, 2023

Improve workflow for PubChem database test

dataset

feature

Status: Open.

#102 In TUCAN-nest/TUCAN;

· schatzsc opened on Jan 12, 2023

pyproject.toml: move matplotlib and tabulate to drawing dependencies

Status: Open.

#101 In TUCAN-nest/TUCAN;

· JanCBrammer opened on Jan 10, 2023

Improve workflow for ChEMBL database test

dataset

feature

Status: Open.

#98 In TUCAN-nest/TUCAN;

· flange-ipb opened on Nov 18, 2022

graph_from_smiles() missing

feature

Status: Open.

#85 In TUCAN-nest/TUCAN;

· schatzsc opened on Oct 15, 2022

Use element_color node attribute in drawing

Status: Open.

#84 In TUCAN-nest/TUCAN;

· schatzsc opened on Oct 14, 2022

Automatically update demo notebook with GitHub Actions

Status: Open.

#82 In TUCAN-nest/TUCAN;

· JanCBrammer opened on Oct 13, 2022

Problem with canonicalization of favipiravir

bugSomething isn't workingSomething isn't working

Status: Open.

#69 In TUCAN-nest/TUCAN;

· schatzsc opened on Aug 3, 2022

Web-based demo version

feature

Status: Open.

#67 In TUCAN-nest/TUCAN;

· JanCBrammer opened on Jul 27, 2022

Implement Krotko's atom-invariants.

Status: Open.

#53 In TUCAN-nest/TUCAN;

· JanCBrammer opened on Apr 19, 2022