Compliance screen of 45M compounds in a weekend
Posted by
Ákos Papp
on 2023-04-03
Drug monitoring organizations report that new psychoactive substances continue to emerge. To keep pace with this ever-evolving situation, countries have introduced new types of legal responses such as generic control of substances.
Organizations handling large collections of molecules need robust cheminformatics tools to identify controlled substances. It is especially important to have a high-performance solution when generic definitions are translated into a digital representation, typically in the form of Markush structures.
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