|
INDIGO installation does not work on KNIME 3.4.4
|
|
3
|
606
|
June 23, 2023
|
|
Vernalis Matched Molecular Pairs (MMP) Nodes updated
|
|
1
|
404
|
June 23, 2023
|
|
Changes to RCSB PDB queries
|
|
1
|
473
|
June 23, 2023
|
|
Identifying Molecular and Electronic Rearrangements
|
|
3
|
461
|
June 23, 2023
|
|
Clarification on the functioning of the Model Acceptability Criteria node
|
|
4
|
620
|
June 23, 2023
|
|
Calculating MEQI keys
|
|
2
|
528
|
January 4, 2022
|
|
Automated Matched Pairs node generates duplicate transformations
|
|
2
|
568
|
June 23, 2023
|
|
OpenEye Python scripts integration
|
|
2
|
1297
|
June 23, 2023
|
|
Match reactants structures with products structures
|
|
3
|
598
|
June 23, 2023
|
|
Can't configure OpenBabel node in Knime
|
|
2
|
432
|
June 23, 2023
|
|
Can't configure OpenBabel node in Knime
|
|
2
|
607
|
June 23, 2023
|
|
XlogP sdf mol2
|
|
2
|
463
|
June 23, 2023
|
|
What is a framework to generate crystal structures for different metallic compound and then calculate its respective descriptors
|
|
2
|
665
|
June 23, 2023
|
|
6th SIG ChemInf meeting on April, 25th
|
|
1
|
355
|
June 23, 2023
|
|
Is there a simple way to count functional groups?
|
|
5
|
2587
|
June 23, 2023
|
|
OpenBabel Conversion Problem
|
|
2
|
593
|
June 23, 2023
|
|
Bug fix: Binary Scorer Binner Performance
|
|
1
|
458
|
June 23, 2023
|
|
New BioSolveIT nodes!
|
|
2
|
989
|
June 23, 2023
|
|
Chemaxon issues with using MolImporter in existing nodes?
|
|
2
|
437
|
June 23, 2023
|
|
Openbabel optional parameters usage
|
|
1
|
482
|
June 23, 2023
|
|
OpenBabel node fasta -> smiles force to be peptide?
|
|
3
|
576
|
June 23, 2023
|
|
Smiles to IUPAC names
|
|
3
|
2876
|
June 23, 2023
|
|
KNIME crashes upon confirming node settings
|
|
2
|
382
|
June 23, 2023
|
|
5th SIG ChemInf meeting on October 18th
|
|
2
|
452
|
June 23, 2023
|
|
How to: determine from drawn peptide structure the sequence (AAs and position)?
|
|
4
|
708
|
June 23, 2023
|
|
3D Coordinates Output?
|
|
11
|
2987
|
June 23, 2023
|
|
FROM CSV TO SDF
|
|
4
|
5896
|
June 23, 2023
|
|
Save Knime node and load it in weka
|
|
2
|
490
|
June 23, 2023
|
|
CDK numbering to Maestro Numbering
|
|
2
|
409
|
June 23, 2023
|
|
Filter properties after carbons with a hydrogen bond
|
|
3
|
377
|
June 23, 2023
|