“Crystal Math” uses equations—and minimal resources—to rapidly predict the 3D structures of molecular crystals, which could speed up R&D for drugs and electronic devices. Researchers at New York ...

“Crystal Math” uses equations—and minimal resources—to rapidly predict the 3D structures of molecular crystals, which could speed up R&D for drugs and electronic devices Researchers at New York ...

Illustrations of the solutions of equation (10) for the Zernike order parameters. Credit: Nature Communications (2024). DOI: 10.1038/s41467-024-53596-5 Researchers at New York University have devised ...

Illustrating the steps of Crystal Math for aspirin: The procedure starts with a simple molecular diagram of the compound, information from this diagram is fed into the equations of Crystal Math, and ...

Researchers have devised a mathematical approach to predict the structures of crystals -- a critical step in developing many medicines and electronic devices -- in a matter of hours using only a ...