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RDKit
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| Topic | Replies | Created | Last reply | |
|---|---|---|---|---|
|
adjacency/connection table | 0 | 2 weeks 4 days ago by InsilicoConsulting |
n/a |
|
|
FCFP_4 or FCFP_6 fingerprints in KNIME | 1 | 7 weeks 2 days ago by stud |
4 weeks 1 day ago by James Davidson |
|
|
Diversity Picker node | 6 | 32 weeks 2 days ago by greglandrum |
4 weeks 2 days ago by filips |
|
|
RDkit installation | 2 | 4 weeks 4 days ago by Nico1990 |
4 weeks 3 days ago by Nico1990 |
|
|
Run time / memory problems using Molecule Fragmenter | 0 | 7 weeks 2 days ago by stud |
n/a |
|
|
using RDKIT in knime through Python node | 1 | 10 weeks 3 days ago by fab |
10 weeks 19 hours ago by greglandrum |
|
|
Common Scaffold Detection | 6 | 13 weeks 6 days ago by richards99 |
13 weeks 2 days ago by richards99 |
|
|
Handling of MDL query features (link nodes) | 0 | 15 weeks 3 hours ago by James Davidson |
n/a |
|
|
Molecule Format Acceptance | 1 | 15 weeks 6 days ago by richards99 |
15 weeks 4 days ago by greglandrum |
|
|
"RDKit Functional Group List Count" node Request | 0 | 16 weeks 16 hours ago by richards99 |
n/a |
|
|
Unhashed Morgan FPs ? | 2 | 17 weeks 5 hours ago by grimbart |
16 weeks 1 day ago by grimbart |
|
|
New RDKit nodes and features. | 3 | 18 weeks 5 days ago by greglandrum |
18 weeks 3 days ago by greglandrum |
|
|
Two component reaction: chirality and Smarts | 4 | 19 weeks 3 days ago by lcollia |
19 weeks 4 hours ago by lcollia |
|
|
substructure matching with attachments | 1 | 22 weeks 3 hours ago by InsilicoConsulting |
19 weeks 3 days ago by greglandrum |
|
|
Circular Fingerprint Feature Retrieval | 1 | 19 weeks 3 days ago by randomresearcher101 |
19 weeks 3 days ago by greglandrum |
|
|
Two Component Reaction Node: Reactants 2 column name choices the same as those of Reactants 1 | 11 | 24 weeks 1 day ago by fboes |
23 weeks 4 days ago by greglandrum |
|
|
Installing RDKit | 6 | 48 weeks 20 hours ago by Angus |
25 weeks 6 days ago by Wolfgang Klute |
|
|
RDKit One Component Reaction Error | 0 | 28 weeks 3 days ago by richards99 |
n/a |
|
|
RDKit One Component Reaction | 6 | 29 weeks 18 hours ago by richards99 |
28 weeks 5 days ago by greglandrum |
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|
Problem with R-group decomposer | 5 | 37 weeks 3 days ago by James Davidson |
33 weeks 5 days ago by James Davidson |
|
|
RDkit Two component node problem | 2 | 37 weeks 3 days ago by Gilbert |
37 weeks 2 days ago by Gilbert |
|
|
Substructure query match counter | 0 | 40 weeks 4 days ago by s.roughley |
n/a |
|
|
3class model with Morgan fp | 7 | 42 weeks 3 days ago by pc |
42 weeks 1 day ago by richards99 |
|
|
Automatic atachment /R sites | 2 | 44 weeks 4 days ago by InsilicoConsulting |
44 weeks 3 days ago by InsilicoConsulting |
|
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new node request | 1 | 45 weeks 3 days ago by fab |
45 weeks 3 days ago by greglandrum |