News of 2025-09 Sep

This is the news of September 2025.

• we are building H30-H33 P300-350 in zinc-22c.
• we have removed zinc-22n/H24 from Wynton to make space
• currently is [a-m] for all tranches in all layers, except zinc-22n where H24, H25, H26 are missing

• we are creating a new version of the 3d building pipeline that uses the Uppsala drop-in replacements for auxilliary programs.
• we are working on natural products (more soon)

Change coming by the end of September 2025

• to cover all tranches and layers evenly, we are changing what we load on Wynton.
• 100% to H19.
• 100% from H27 to H49
• 38% from H20 to H26, evenly spread over all layers and tranches.
• thus 100% of zinc-22?/H[01]?/H??[PM]???/[a-z]/*.db2.tgz. 100%
• 100% of zinc-22/H2[789]/ and 100% of zinc-22/H[34]?/
• 38% of zinc-22?/H2[0-6]/H??[PM]???/[a-j]/*.db2.tgz. 38%
• Only on gimel: zinc-22?/H[234]?/H??[PM]???/[k-z]/*.db2.tgz. 62%.
• Footprint on Wynton of ZINC-22: about 1.2-1.3 PB.
• Foot print on Gimel2 of ZINC-22: about 3.3 PB. (as of Sept 19, 2025)
• 100% of b, c (H30+)
• 100% of bb, cc (zwitterions)
• the macrocycles in zinc-22w and zinc-22e have been retired to zinc-22ww and zinc-22ee respectively and are no longer part of offical ZINC-22. zinc-22e and zinc-22w are currently empty and may hold the next update of macrocycles.

The simple version I can remember

• 100% to H19. and H27 to H49. IN PROGRESS. NEARLY READY.
• 38% H20-H26, uniform coverage. IN PROGRESS
• 100% of bb, cc, and z (zwitterions) IN PROGRESS
• 100% of a,g (in stock / informer sets) TRUE NOW
• 0% macrocycles, for now. TRUE NOW.

This means:

• you can dock an even representative sample of ZINC-22 on Wynton.
• you can dock 100% of ZINC-22 up to H19.
• if you want to dock H20 or above, you must use gimel.

Thank you for reading. Please let your IT team know of any concerns.