A simple spatial extension to the extended connectivity interaction features for binding affinity prediction
Journal article, 2022
protein binding affinity prediction
machine learning
scoring functions
Author
Oghenejokpeme I. Orhobor
University of Cambridge
Abbi Abdel Rehim
University of Cambridge
Hang Lou
University of Cambridge
Hao Ni
Alan Turing Institute
University College London (UCL)
Ross King
University of Cambridge
Alan Turing Institute
Chalmers, Biology and Biological Engineering, Systems and Synthetic Biology
Royal Society Open Science
2054-5703 (eISSN)
Vol. 9 5 211745Subject Categories
Biochemistry and Molecular Biology
Biophysics
Bioinformatics (Computational Biology)
DOI
10.1098/rsos.211745