Releases: 3D-e-Chem/knime-kripodb
Release list
v3.0.1
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher and KNIME 5.1 or higher.
Changed
- Require KNIME 5.1
v3.0.0
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher.
Removed
- Python based nodes in favour of web service nodes (#25)
v2.5.0
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher.
Deprecated
- Python based nodes in favour of web service nodes (#25)
v2.4.2
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher.
Changed
- Requires KNIME 4.0 (#29)
v2.4.1
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher.
Fixed
- Last update of web service in node description [#28]
v2.4.0
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher.
Changed
- Allow Python node to use Python 2 or 3
- Require KNIME 3.5
v2.3.0
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.3.0 or higher.
Added
- Node to fetch pharmacophore from local db file (#12)
- Node to fetch pharmacophore from webservice (#12)
Changed
- Require KNIME 3.3
v2.2.0
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.2.0 or higher.
Added
- Pure Java nodes to fetch fragment information and similarites from web service (#17)
Changed
- Python nodes only work for local files, no longer for web service urls
v2.1.5
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.
Requires KripoDB v2.2.0 or higher.
Added
- Fragment information node fails completely when just one of the fragment ids is wrong (#11)
- Fragment similarity node gives warnings for query fragment ids that can not be found
v2.1.3
KNIME nodes for KripoDB (https://github.com/3D-e-Chem/kripodb).
KripoDB is a Python package used to interact with Kripo fragment, fingerprint and similarity data files.
KRIPO stands for Key Representation of Interaction in POckets, see reference for more information.