You cannot build a training set in chemistry large enough because of the context. You have 10 60 different molecules. You have 30,000 different proteins, and among each of those different proteins ...

For the past five years, Schrodinger (SDGR 0.04%) ... Finally, the method of combinatorial chemistry isn't just applicable to drugs and medicines, but also toward the discovery of new materials.

One of the most bizarre ideas about the quantum Universe is the notion of indeterminate states. In our conventional, macroscopic Universe, we're used to things simply existing in a particular, non ...