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Pathway Enrichment Analysis
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2
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34
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March 11, 2025
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RDKit Molecular Extractor crashes on ChEBI data
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1
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19
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February 1, 2025
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RDKit for molecules: Keep Hs
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2
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133
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November 20, 2024
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RDKIT from molecule note does not recognize my smiles codes
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7
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468
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August 25, 2024
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Filtering 2D
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2
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378
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July 22, 2024
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Structure-Activity Landscape Index workflow
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1
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529
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April 30, 2024
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3D ligand and protein visualization from KNIME 5.x
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3
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655
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December 15, 2023
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Type mapping for chemistry types in 5.2 available
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1
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511
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March 7, 2024
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CHEMBL data from InChi Keys input
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4
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749
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November 28, 2023
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CIR (Chemical Identifier Resolver)
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3
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616
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November 2, 2023
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ERROR: RDKitAdapterCellValueFactory Python Script: Error when deserializing RDKitMolValue
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6
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989
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December 5, 2023
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Clustering of docked poses
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3
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1240
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December 4, 2023
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Problems with threshold parameter of RDKit MCS node
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5
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866
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October 25, 2023
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Is there a way to assure in Random Forest Predictor, ROC Curves, that the desired parameters appear?
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4
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898
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October 24, 2023
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Splitting table in pairs of 2 columns
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3
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990
|
September 9, 2023
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Tanimoto similarity for pairs of compounds
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17
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3131
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June 23, 2023
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Cheminformatics Heatmap
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5
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1506
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June 21, 2023
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RDF file reader/fixer/converter (replace or add-on to Erlwood Reactions File Reader)
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4
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1812
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December 22, 2022
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Automated Matched Pair error
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2
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1107
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March 5, 2023
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Peptide reader
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6
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1852
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December 2, 2022
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DNA to Protein translator
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7
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1395
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December 2, 2022
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3D rmsd of substructure vs larger molecule
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18
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2840
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May 13, 2022
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RDKIT descriptors
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4
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2723
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March 22, 2022
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Fingerprints export to csv file
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4
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1457
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March 21, 2022
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Info about a node request
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1
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1186
|
February 27, 2022
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Analysing Fourier Transform Infra Red Spectroscopy data in KNIME
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3
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2113
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June 23, 2023
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Similarity search, bins and murcko scaffolds
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4
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1859
|
September 13, 2021
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Identifying endmembers in point data
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2
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1180
|
February 18, 2022
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Smarts search in 3D or searching patterns in a sphere
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2
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1178
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February 3, 2022
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Workflow Corruption, KNIME 3.6 & MOE
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14
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2873
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June 23, 2023
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