Explainable chemical artificial intelligence from accurate machine learning of real-space chemical descriptors

  1. Gallegos, M.
  2. Vassilev-Galindo, V.
  3. Poltavsky, I.
  4. Martín Pendás, Á.
  5. Tkatchenko, A.
Journal:
Nature Communications

ISSN: 2041-1723

Year of publication: 2024

Volume: 15

Issue: 1

Type: Article

DOI: 10.1038/S41467-024-48567-9 GOOGLE SCHOLAR lock_openOpen access editor