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3D ligand and protein visualization from KNIME 5.x
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1
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94
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December 4, 2023
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CHEMBL data from InChi Keys input
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3
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67
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November 28, 2023
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CIR (Chemical Identifier Resolver)
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3
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95
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November 2, 2023
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ERROR: RDKitAdapterCellValueFactory Python Script: Error when deserializing RDKitMolValue
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5
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289
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September 6, 2023
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Clustering of docked poses
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3
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294
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December 4, 2023
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OpenBabel binary inputs?
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5
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538
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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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324
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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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321
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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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418
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September 9, 2023
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Tanimoto similarity for pairs of compounds
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17
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2131
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June 23, 2023
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Cheminformatics Heatmap
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5
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788
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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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1208
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December 22, 2022
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Automated Matched Pair error
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2
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650
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March 5, 2023
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Peptide reader
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6
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934
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December 2, 2022
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DNA to Protein translator
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7
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774
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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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1664
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May 13, 2022
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RDKIT descriptors
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4
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1462
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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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845
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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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711
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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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1550
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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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1108
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September 13, 2021
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Identifying endmembers in point data
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2
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731
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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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733
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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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2187
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June 23, 2023
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mol2 writer does not encode molecular title
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4
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1121
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May 20, 2021
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Optimizing a workflow analyzing the similarity distance to the nearest neighbour in a compound library.
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8
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1137
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May 5, 2021
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USPTO reaction smiles - yield curation
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1
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1124
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April 23, 2021
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Using crystal structure as template for 3D coordinates for new molecules
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3
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905
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April 18, 2021
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Drug molecule similarity extraction from ChEMBL
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1
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788
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April 15, 2021
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¿Como hago une ejecutable (.exe) de un flujo en knime?
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1
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1525
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March 31, 2021
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