GRADE and X‑GRADE: Unveiling Novel Protein–Ligand Interaction Fingerprints Based on GRAIL Scores.
Title: | GRADE and X‑GRADE: Unveiling Novel Protein–Ligand Interaction Fingerprints Based on GRAIL Scores. |
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Authors: | Fellinger, Christian, Seidel, Thomas, Merget, Benjamin, Schleifer, Klaus-Juergen, Langer, Thierry |
Source: | Journal of Chemical Information & Modeling; 3/10/2025, Vol. 65 Issue 5, p2456-2475, 20p |
Database: | Supplemental Index |
ISSN: | 15499596 |
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DOI: | 10.1021/acs.jcim.4c01902 |
Published in: | Journal of Chemical Information & Modeling |
Language: | English |