ZINC15:Backlog: Difference between revisions

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* maybe move retired from zinc12 to zinc15
* maybe move retired from zinc12 to zinc15


* change purchasable to for-sale in subsets
* descriptions, counts in subsets
* create subsets of targets
* lead-like, frag-like, drug-like subsets






[[Category:Curator]]
[[Category:Curator]]

Revision as of 03:56, 2 October 2015

ZINC catalog processing pipeline

received 2015-09 but not done

  • EDASA
  • others in in box.
  • hmdbendo still contains aspirin. somehow. must remove.
  • remove smpdb from metabolites (and update values)
  • remove fingerprints of benched
  • maybe move retired from zinc12 to zinc15
  • change purchasable to for-sale in subsets
  • descriptions, counts in subsets
  • create subsets of targets
  • lead-like, frag-like, drug-like subsets