News of 2024-09 Sept: Difference between revisions
Jump to navigation
Jump to search
(asdf) |
m (asdf) |
||
| Line 15: | Line 15: | ||
zinc-22n H25P080 | zinc-22n H25P080 | ||
A total of 11100 db2.tgz (that contain mol2 but should contain db2) were found. Thanks to the lab of Jens Carlsson and especially Israel Cabeza de Vaca for help with this! | |||
* Aug 28, 2024 - these tranches were deleted on BKSlab, AWS and Wynton | * Aug 28, 2024 - these tranches were deleted on BKSlab, AWS and Wynton | ||
(estimated below) | |||
* Sep 1, 2024 - rebuilding started | * Sep 1, 2024 - rebuilding started | ||
* Oct 1, 2024 - start installing new files | * Oct 1, 2024 - start installing new files | ||
Revision as of 18:06, 28 August 2024
Some db2.gz files were incorrectly mol2.tgz files
To correct this problem, we must
- delete the existing tranches
- rebuild the molecules
- put the new files in place, including in AWS
- tell users to download the new versions
Here are the affected tranches:
zinc-22n H22P080 zinc-22n H23P130 zinc-22n H24P030 zinc-22n H24P040 zinc-22n H25P080
A total of 11100 db2.tgz (that contain mol2 but should contain db2) were found. Thanks to the lab of Jens Carlsson and especially Israel Cabeza de Vaca for help with this!
- Aug 28, 2024 - these tranches were deleted on BKSlab, AWS and Wynton
(estimated below)
- Sep 1, 2024 - rebuilding started
- Oct 1, 2024 - start installing new files
- Nov 1, 2024 - update complete. make announcement on twitter.