In addition to an interest in computer modeling and statistical analysis methods, a career in computational chemistry requires patience, logical thinking, and attention to detail. “People skills” are ...

Machine learning is totally overhyped. Machine learning is completely not overhyped. Machine learning is transformative. Machine learning is a tool like any other. Ask 10 chemists what they think ...

Structural biology and computational chemistry can combine to accelerate the delivery of clinical candidates with excellent overall profiles. For instance, today it is possible to use state-of-the art ...

During one of Gabe Gomes’s first chemistry lectures at the Federal University of Rio de Janeiro, a professor walked up to the board and wrote the Schrödinger equation for the class. “All of chemistry ...