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DeepNeuralNet-QSAR

Merck/DeepNeuralNet-QSAR

65 stars27 forksPythonAdded February 5, 2026
summary

DeepNeuralNet-QSAR is a Python tool developed for predicting molecular properties using deep neural networks. It allows users to train models on QSAR datasets and make predictions for various molecular tasks, facilitating drug discovery and molecular design.

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