RosENet: Improving Binding Affinity Prediction by Leveraging Molecular Mechanics Energies with an Ensemble of 3D Convolutional Neural Networks

Published 2020 View Full Article

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Title
RosENet: Improving Binding Affinity Prediction by Leveraging Molecular Mechanics Energies with an Ensemble of 3D Convolutional Neural Networks
Authors
Keywords
-
Journal
Journal of Chemical Information and Modeling
Volume -, Issue -, Pages -
Publisher
American Chemical Society (ACS)
Online
2020-05-12
DOI
10.1021/acs.jcim.0c00075

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