2026
Quantum Methods in Drug Discovery: An Introduction to the Theoceptor (Theoretical Receptor) Approach.
Theoceptor method can be applied to X-ray crystallography- or cryo-electron microscopy-derived structures, can be applied equally to covalent and noncovalent binders, and can provide excellent predictions for the changes in activity between matched molecular pairs.
Nikeel Cull, Yixin He, Sylvia C. Kaempf et al.
· Methods in molecular biology · 0 citations