ZINC20 Warehousing Scripts: Difference between revisions

From DISI
Jump to navigation Jump to search
Line 7: Line 7:


* This script will update the substance table's purchasable, free, bb, purchasable_since columns.
* This script will update the substance table's purchasable, free, bb, purchasable_since columns.
   python /nfs/home/s_mar/warehousing.py '''start end delta'''
   python /nfs/home/s_mar/warehouse.py '''start end delta'''

Revision as of 22:18, 18 October 2024

These scripts are used to update Zinc20 Molecules and their catalog information.

Source Python environment before running

source /nfs/home/s_mar/warehousing/bin/activate

Updating Catalog Information

  • This script will update the substance table's purchasable, free, bb, purchasable_since columns.
 python /nfs/home/s_mar/warehouse.py start end delta