Sign Up to like & get
recommendations!
1
Published in 2022 at "ACS Omega"
DOI: 10.1021/acsomega.2c02227
Abstract: Automatic search of cavities and binding mode analysis between a ligand and a 3D protein receptor are challenging problems in drug design or repositioning. We propose a solution based on a shape theory theorem for…
read more here.
Keywords:
molecular docking;
invariant coupled;
ligand;
theory applied ... See more keywords