Generalized biomolecular modeling and design with RoseTTAFold All-Atom - Krishna, Rohith; Wang, Jue; Ahern, Woody; Sturmfels, Pascal; Venkatesh, Preetham; Kalvet, Indrek; Lee, Gyu Rie; Morey-Burrows, Felix S.; Anishchenko, Ivan; Humphreys, Ian R.; McHugh, Ryan; Vafeados, Dionne; et al. (Science (American Association for the Advancement of Science), 2024)
Keywords: Accuracy; Additives; Amino acids; Amino Acids - chemistry; Assemblies; Binding; Bond graphs; Cell signaling; Chemical bonds; Chemical elements; Chemistry; Chirality; Coronary artery disease; Covalence; Crystal structure; Crystallization; Crystallography; Deep Learning; Design; Digoxigenin; DNA - chemistry; Gas pipelines; Graph representations; Graphical representations; Heart diseases; Heme; Homology; Ligands; Machine learning; Metal ions; Metals; Modelling; Models, Molecular; Networks; Neural networks; Nucleic acids; Optical activity; Organic Chemistry; Physical chemistry; Polypeptides; Predictions; Protein Engineering - methods; Protein structure; Proteins; Proteins - chemistry; Residues; Similarity; Structure-function relationships