I'm one of the founders of Rowan, where I lead product and strategy. At Rowan, we're accelerating molecular simulation with ML and building tools to help chemists harness those simulations.
Before starting Rowan, I attended Northeastern. I post on Substack and Twitter.
Neural network potentials are ML models used to approximate solution of the Schrödinger equation, which describes how systems of atoms will behave with quantum accuracy.
With help, I maintain:
Other helpful NNP links: