The most common method used to study protein structures is X-ray crystallography. With this method, solid crystals of purified protein are placed in an X-ray beam, and the pattern of deflected X ...

including in structure-based drug design. Drago began exploring a technique to pinpoint otherwise elusive hydrogens that ...

After conceiving a new model, the lead authors, Yuuki Kubo and Shiji Tsuneyuki, confirmed its proficiency by applying it to ...

"The crystal structures of the real world are extremely diverse. They are one of nature's deepest mysteries," says Kubo, the first author of the paper. "We thought that, in a way, we could get a ...

which is trained on crystal protein–ligand complexes to estimate pose confidence. In addition, SurfDock integrates multimodal protein information such as surface features, residue structure ...

A protein has many identities and one of them ... (This method reveals a crystal’s structure based on how its constituent atoms scatter X-rays. For this the proteins need to be purified and ...