tml#torchdrug.models.MessagePassingNeuralNetwork" title="torchdrug.models.MessagePassingNeuralNetwork"><code class="xref py py-class docutils literal notranslate"><span class="pre">MessagePassingNeuralNetwork</span></code></a></p>
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<li><p><a class="reference external" href="https://aip.scitation.org/doi/pdf/10.1063/1.5019779">SchNet: A continuous-filter convolutional neural network for modeling quantum interactions</a></p>
<p>Kristof T. Schütt, Pieter-Jan Kindermans, Huziel E. Sauceda, Stefan Chmiela,