Heisenberg is a quantum-informed AI platform developed by Famous Labs to support small-molecule drug discovery. It is designed to help drug discovery teams prioritize synthesis, reduce experimental ...

Learn about the importance of quantum chemistry in targeting mutant proteins effectively in drug discovery for ...

Even as quantum computing advances steadily, it will not replace classical computers in the near future. Most current systems ...

Theoretical quantum chemistry is a central discipline that applies the principles of quantum mechanics to decipher and predict the behaviour of molecular systems. It bridges abstract mathematical ...

Quantum chemistry is helping scientists understand why some chemical reactions succeed while others fail, by showing how the movement of electrons affects each step ...

A web platform uses a chatbot to enable any chemist -- including undergraduate chemistry majors -- to configure and execute complex quantum mechanical simulations through chatting. Advanced ...

Computational Chemistry is the study of complex chemical problems using a combination of computer simulations, chemistry theory and information science. Also called cheminformatics, this field enables ...

A new computational approach developed at the University of Chicago promises to shed light on some of the world’s most puzzling materials—from high-temperature superconductors to solar cell ...

A new technical paper titled “From Promise to Practice: Benchmarking Quantum Chemistry on Quantum Hardware” was published by researchers at Rensselaer Polytechnic Institute and IBM T.J. Watson ...

The acceptance of molecules as 3D structures led to major advances in chemistry, with quantum mechanics providing the theoretical framework. Early successes, like modeling the neutral H2 molecule, ...