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Could not initialize class
|
|
3
|
78
|
August 1, 2025
|
|
CDK still supported? Molecule to cdk node fails to convert
|
|
2
|
73
|
June 5, 2025
|
|
Can't access CDK bundle in Java Snippet node
|
|
2
|
445
|
January 31, 2025
|
|
CDK Opsin Node in KNIME not working properly?
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|
17
|
866
|
May 8, 2023
|
|
substructure node cannot deal with explicit hydrogens
|
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3
|
645
|
October 21, 2022
|
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smarts query node - problems with different SMARTS lists
|
|
3
|
554
|
October 20, 2022
|
|
CDK Fingerprint similarity - "all against all" - Error "Cell at index 1 is null!"
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2
|
846
|
April 21, 2023
|
|
Tautomer Generator with RDKit nodes
|
|
5
|
928
|
March 8, 2022
|
|
ArrayIndexOutOfBounds when connecting 'Molecule to CDK' to 'PaDEL-Descriptor'
|
|
4
|
1101
|
April 21, 2023
|
|
Tautomer Generator "Object missing ('?')"
|
|
1
|
725
|
April 21, 2023
|
|
CDK Atom Numbering
|
|
2
|
958
|
April 21, 2023
|
|
RMSD calculation
|
|
1
|
1083
|
April 21, 2023
|
|
Stereochemistry - Canonicalized Tautomers
|
|
3
|
1059
|
April 21, 2023
|
|
List of Each meanings of CDK descriptions in KNIME-CDK Molecular Properties node
|
|
3
|
2320
|
April 21, 2023
|
|
Molecule to CDK node gives missing object with valid SMILES
|
|
3
|
1063
|
April 21, 2023
|
|
IAtomContainer now accessible in Java Snippets (trunk)
|
|
2
|
882
|
April 21, 2023
|
|
Problem with nitrile coordinates generated by Molecule to CDK node
|
|
3
|
873
|
April 21, 2023
|
|
CDK Largest Chain descriptor inconsistencies
|
|
11
|
1418
|
April 21, 2023
|
|
CDK Atom numbering
|
|
10
|
1669
|
April 21, 2023
|
|
Trunk update: Issue with Smarts Query
|
|
2
|
843
|
April 21, 2023
|
|
org.openscience.cdk.depict missing from CDK jar
|
|
9
|
1081
|
April 21, 2023
|
|
CDK SMARTS Matcher update (trunk)
|
|
1
|
822
|
April 21, 2023
|
|
CDK Depiction node contribution
|
|
2
|
875
|
April 21, 2023
|
|
CDK Render handling of missing cells
|
|
2
|
947
|
April 21, 2023
|
|
CDK molecular property node: invalid properties issue
|
|
3
|
877
|
April 21, 2023
|
|
BUG: CDK property values depend on calculated property subset
|
|
19
|
1509
|
April 21, 2023
|
|
Properties lost through serialization?
|
|
3
|
870
|
April 21, 2023
|
|
Generating Bit Strings using SMARTs query node
|
|
5
|
1316
|
April 21, 2023
|
|
Buggy behavior of “Molecule to CDK” node
|
|
8
|
1247
|
April 21, 2023
|
|
CDK SMARTS fragments counter
|
|
12
|
1514
|
April 21, 2023
|