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DeepDrug3D: Classification of ligand-binding pockets in proteins with a convolutional neural network

Table 3

Percentage of binding residues forming specific interactions with ligands.

Binding residues are identified by the class-activation map analysis to be part of the highly discriminative regions of nucleotide- and heme-binding pockets. Three types of interactions reported by the LPC program are considered, hydrogen bonds, aromatic and hydrophobic contacts.

Table 3

doi: https://doi.org/10.1371/journal.pcbi.1006718.t003