Continuous curation: Difference between revisions

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Revision as of 03:50, 15 November 2016

This is the continuous curation page. This serves to communicate current status among the curators, and also to the users of ZINC, what the current status of ZINC curation is.

2D (catalog) loading

  • now loading: molport and enamine-v
  • queued and ready for loading: molport-v
  • awaiting post-loading curation : DONE5 directory (count unique, update filtered, counts)

3 D (protomer) loading

  • protomer building and loading is currently on hold until we have new disk space ready (expect to resume loading Nov 20)
  • we are currently building Ellman in 3D

2D exporting

We export 2D by property (tranche browser) over 3 week period beginning on the first of the month. You can see the date we last updated each tranche using files.docking.org/2D

3D exporting

Exporting 3D for the tranche browser runs continuously and takes slightly longer than a month to run. You can see the date we last updated each tranche using files.docking.org/3D

Ring curation status

Pattern curation status

Ring counts, pattern counts

Biological table counts

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