Blind protein structure prediction using accelerated free-energy simulations

por Perez, Alberto, Morrone, Joseph A., Brini, Emiliano, MacCallum, Justin L., Dill, Ken A.
Publicado 2016

Simplified, interpretable graph convolutional neural networks for small molecule activity prediction

por Weber, Jeffrey K., Morrone, Joseph A., Bagchi, Sugato, Pabon, Jan D. Estrada, Kang, Seung-gu, Zhang, Leili, Cornell, Wendy D.
Publicado 2021