@misc{indiciae2ccd8d16de57,
  title = {Extending quantum-mechanical benchmark accuracy to biological ligand-pocket interactions},
  author = {Puleva, Mirela [University of Luxembourg, Luxembourg City, (Luxembourg); University of Luxembourg, Esch-sur-Alzette, (Luxembourg)] (ORCID:0000000198536775) and Medrano Sandonas, Leonardo [University of Luxembourg, Luxembourg City, (Luxembourg); Technische Universität Dresden (Germany)] (ORCID:0000000276733142) and Lőrincz, Balázs D. [Budapest University of Technology and Economics (Hungary); HUN-REN-BME Quantum Chemistry Research Group, Budapest (Hungary); MTA-BME Lendület Quantum Chemistry Research Group, Budapest (Hungary)] and Charry, Jorge [University of Luxembourg, Luxembourg City, (Luxembourg); Luxembourg Researchers Hub asbl, Esch-sur-Alzette (Luxembourg)] (ORCID:0000000330692522) and Rogers, David M. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). National Center for Computational Sciences (NCCS)] (ORCID:0000000251871768) and Nagy, Péter R. [Budapest University of Technology and Economics (Hungary); HUN-REN-BME Quantum Chemistry Research Group, Budapest (Hungary); MTA-BME Lendület Quantum Chemistry Research Group, Budapest (Hungary)] (ORCID:0000000166920879) and Tkatchenko, Alexandre [University of Luxembourg, Luxembourg City, (Luxembourg); University of Luxembourg, Esch-sur-Alzette, (Luxembourg)] (ORCID:0000000210124854)},
  year = {2025},
  doi = {10.1038/s41467-025-63587-9},
  url = {https://www.osti.gov/biblio/3002399},
  note = {Source identifier: 3002399}
}