Search Results for author: Michal Brylinski

Found 2 papers, 2 papers with code

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

1 code implementation Plos Computational Biology 2019 Limeng Pu, Rajiv Gandhi Govindaraj, Jeffrey Mitchell Lemoine, Hsiao-Chun Wu, Michal Brylinski

Interestingly, the analysis of strongly discriminative regions of binding pockets reveals that this high classification accuracy arises from learning the patterns of specific molecular interactions, such as hydrogen bonds, aromatic and hydrophobic contacts.

Benchmarking Specificity

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