Review
2026
Quantum Chemistry in Drug Design: Applications, Challenges, and the Need for Speed.
Key QM applications-torsional profiles, spectra prediction, reactivity analysis, and modeling of non-covalent interactions-highlighting their impact and limitations are reviewed, illustrating the trade-off between speed and accuracy.
C. Tautermann, M. Degroote, Benjamin Ries
· Methods in molecular biology · 0 citations