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KNIME workflows and associated data from Koch et. al...
Created: 2017-06-29 17:26:00 | Last updated: 2017-12-19 10:19:21
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Pack #4 - Metabolome completion and metabolomics
Created: 2017-06-30 16:36:44 | Last updated: 2017-12-19 10:22:42
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Pack #3 - Search for molecules maximizing biological...
Created: 2017-06-30 16:33:44 | Last updated: 2017-12-19 10:22:03
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Pack #2 - Isomer enumeration (isomer transformation ...
Created: 2017-06-30 16:31:31 | Last updated: 2017-12-19 10:21:41
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Pack #1 - Isomer enumeration (canonical augmentation...
Created: 2017-06-30 16:29:21 | Last updated: 2017-12-19 10:20:58
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RetroPath2.0-Mods-isomer-transformation-queue (2)
Created: 2017-10-12 | Last updated: 2017-12-19
Credits: Thomas Duigou BioRetroSynth
Attributions: RetroPath2.0 - a retrosynthesis workflow with tutorial and example data RetroPath2.0-Mods-isomer-transformation
Created: 2017-06-30 17:09:48 | Last updated: 2017-07-03 08:19:12
Credits: Thomas Duigou BioRetroSynth
Attributions: RetroPath2.0-Mods-iQSAR
License: Creative Commons Attribution-Noncommercial-Share Alike 3.0 Unported License
File type: application/x-zip-compressed
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QSAR-model-aminoglycosides (2)
Created: 2017-06-30 | Last updated: 2017-12-19
Credits: Thomas Duigou BioRetroSynth
Created: 2017-06-30 | Last updated: 2017-12-19
Credits: Thomas Duigou BioRetroSynth
Attributions: RetroPath2.0 - a retrosynthesis workflow with tutorial and example data
Created: 2017-06-30 17:01:24 | Last updated: 2017-10-12 13:47:22
Credits: Thomas Duigou BioRetroSynth
Attributions: RetroPath2.0-Mods-isomer-transformation
License: Creative Commons Attribution-Noncommercial-Share Alike 3.0 Unported License
File type: application/x-zip-compressed
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