Cargando…
XLPFE: A Simple and Effective Machine Learning Scoring Function for Protein–Ligand Scoring and Ranking
[Image: see text] Prediction of protein–ligand binding affinities is a central issue in structure-based computer-aided drug design. In recent years, much effort has been devoted to the prediction of the binding affinity in protein–ligand complexes using machine learning (ML). Due to the remarkable a...
| Autores principales: | , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9245135/ https://www.ncbi.nlm.nih.gov/pubmed/35785279 http://dx.doi.org/10.1021/acsomega.2c01723 |