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Fig. 2 | Journal of Cheminformatics

Fig. 2

From: Learnt representations of proteins can be used for accurate prediction of small molecule binding sites on experimentally determined and predicted protein structures

Fig. 2

Pathways implemented to compare multiple models on multiple structures. The four pathways implemented to compare the F1 scores achieved when predicting ligand-binding residues on 21 MD structures. These allowed us to explore the benefit gained from using multiple predictive models and from making predictions on multiple MD structures

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Journal of Cheminformatics

ISSN: 1758-2946

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