ZINC-22:Revision of Feb 1 2022: Difference between revisions
Jump to navigation
Jump to search
(asdf) |
m (asdf) |
||
| Line 12: | Line 12: | ||
-- John Irwin | -- John Irwin | ||
[[Category:ZINC-22-news]] | |||
Revision as of 17:13, 1 February 2022
We are making the following changes to ZINC-22.
Around Jan 1, 2022, we created "2d-12", the latest version of the database.
Around Jan 28, we discovered a canonicalization/duplication problem.
From Feb 1-7, we created a new version, 2d-15, that eliminated the duplication problem (estimated 99% fixed).
We had built molecules in /zinc-22f/ and /zinc-22e/. These have all been removed from ZINC-22.
We have begun 3D building (Feb 7th) of 2d-15 as /zinc-22d/ and /zinc-22c/.
-- John Irwin