Search Results for author: Henry van den Bedem

Found 3 papers, 2 papers with code

Learning physics confers pose-sensitivity in structure-based virtual screening

no code implementations28 Oct 2021 Pawel Gniewek, Bradley Worley, Kate Stafford, Henry van den Bedem, Brandon Anderson

In drug discovery, structure-based virtual high-throughput screening (vHTS) campaigns aim to identify bioactive ligands or "hits" for therapeutic protein targets from docked poses at specific binding sites.

Drug Discovery

Sequence-guided protein structure determination using graph convolutional and recurrent networks

1 code implementation14 Jul 2020 Po-Nan Li, Saulo H. P. de Oliveira, Soichi Wakatsuki, Henry van den Bedem

Single particle, cryogenic electron microscopy (cryo-EM) experiments now routinely produce high-resolution data for large proteins and their complexes.

Cryogenic Electron Microscopy (cryo-EM)

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