Call for a Public Open Database of All Chemical Reactions

Today there exists no public, freely downloadable, comprehensive database of all known chemical reactions and associated information. Such a database not only would serve chemical sciences and technologies around the world but also would enable the power of modern AI and machine learning methods to be unleashed on a host of fundamental problems. In time, this could lead to important scientific discoveries and economic developments for the benefit of humanity. While ideally such a repository ought to be created and maintained by an international consortium, in the near future, it may be easier to begin the process through governmental agencies such as the National Science Foundation or the National Institutes of Health. Working together, we could use a multipronged approach that could combine negotiations with commercial stakeholders, crowd-sourcing efforts, automated extraction methods, and legislative actions.

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WHY JAX COULD BE THE NEXT PLATFORM FOR HPC-AI

So many of Google’s technology developments have had major impacts in the commercial world but the company’s impact on scientific computing has been far less pronounced. Teams at the search engine giant are trying to bridge that gap by creating software tools that blend the best of two worlds — traditional numerical simulations and modern machine learning.

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