Change Log

All notable changes to this project will be documented in this file. This project adheres to Semantic Versioning. The file is formatted as described on http://keepachangelog.com/.

Unreleased

[3.0.0] - 2023-11-23

Changed

Support KNIME 5.1
Replaced knime-python-wrapper dependency with calling sygma executable.
Simplified input/output from molecule types to strings.

2.0.0 - 2021-02-12

Fixed

Support KNIME 4.3 (#16 5)

Removed

Support for KNIME versions older than 4.3

1.2.1 - 2019-06-27

Changes

Requires KNIME 4.0 (#14)

1.2.0 - 2018-02-07

Added

SyGMa icon (#12)

Changed

Switch to new Python wrapper, now possible to also use Python version 3 (#13)

Fixed

Some molecules cause freeze of node (#13)

1.1.5 - 2017-02-17

Fixed

Input smiles type gets converted to string (#7)

1.1.4 - 2017-02-09

Switched to GPLv3 license due to license of Python wrapper dependency.

Changed

Use anaconda sygma package during CI tests

1.1.3 - 2017-01-23

Changed

sygma Python package install instructions in node description (#8)
Better error message when Python package is not found (#8)

1.1.2 - 2017-01-20

Changed

Adjust SyGMa homepage URL (#6)
Renamed Metabolite Predictor node to SyGMa Metabolites (#11)

1.1.1 - 2017-01-20

Added

Feature in 3d-e-chem p2 update site category

Changed

Update site was one version ahead - skip to 1.1.2

1.1.0 - 2016-09-01

Changed

Renamed Predict metabolites node to Metabolite Predictor (#5)
Renamed example workflow (#4)

1.0.2 - 2016-08-15

Added

Test workflows (#2)
Example workflow (#3)

Removed

Redundant column "parent" from output_table

1.0.1 - 2016-07-18

Added

Nest Kripo nodes under /community/3D-e-Chem (#1)

1.0.0 - 2016-07-12

Initial release. Skeleton generated by https://github.com/3D-e-Chem/knime-python-node-archetype