BioinformaticsThe Journal of Physical Chemistry BPeer-reviewed
3D-Scaffold: Deep Learning Framework to Generate 3D Coordinates of Drug-like Molecules with Desired Scaffolds.
Rajendra Prasad Joshi, Niklas W. A. Gebauer, Mridula Bontha…·Neeraj Kumar
The paper introduces a deep learning framework that generates 3D coordinates of drug-like molecules with desired scaffolds, showing it can create valid, novel, and synthesizable molecules with drug-like properties.
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