Articles
Moving beyond pilot purgatory: Scaling AI in drug discovery projects
In this article, Andrew Anderson discusses the challenges of scaling AI pilot projects. From transferring large amounts of data, data engineering and standardization, to the impact of ionization prediction in drug discovery.
Articles
Enhancing Efficiency of Natural Product Structure Revision: Leveraging CASE and DFT over Total Synthesis
In this paper, we propose using CASE and DFT methods as tools for preventive verification of an originally proposed structure, and elucidation of the correct structure if the original structure is deemed to be incorrect.