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Accurate prediction of protein structures and interactions using a three-track neural network.
Baek M, DiMaio F, Anishchenko I, Dauparas J, Ovchinnikov S, Lee GR, Wang J, Cong Q, Kinch LN, Schaeffer RD, Millán C, Park H, Adams C, Glassman CR, DeGiovanni A, Pereira JH, Rodrigues AV, van Dijk AA, Ebrecht AC, Opperman DJ, Sagmeister T, Buhlheller C, Pavkov-Keller T, Rathinaswamy MK, Dalwadi U, Yip CK, Burke JE, Garcia KC, Grishin NV, Adams PD, Read RJ, Baker D. Baek M, et al. Among authors: millan c. Science. 2021 Aug 20;373(6557):871-876. doi: 10.1126/science.abj8754. Epub 2021 Jul 15. Science. 2021. PMID: 34282049 Free PMC article.
Exploiting distant homologues for phasing through the generation of compact fragments, local fold refinement and partial solution combination.
Millán C, Sammito MD, McCoy AJ, Nascimento AFZ, Petrillo G, Oeffner RD, Domínguez-Gil T, Hermoso JA, Read RJ, Usón I. Millán C, et al. Acta Crystallogr D Struct Biol. 2018 Apr 1;74(Pt 4):290-304. doi: 10.1107/S2059798318001365. Epub 2018 Apr 3. Acta Crystallogr D Struct Biol. 2018. PMID: 29652256 Free PMC article.
Assessing the utility of CASP14 models for molecular replacement.
Millán C, Keegan RM, Pereira J, Sammito MD, Simpkin AJ, McCoy AJ, Lupas AN, Hartmann MD, Rigden DJ, Read RJ. Millán C, et al. Proteins. 2021 Dec;89(12):1752-1769. doi: 10.1002/prot.26214. Epub 2021 Aug 21. Proteins. 2021. PMID: 34387010 Free PMC article.
Improved AlphaFold modeling with implicit experimental information.
Terwilliger TC, Poon BK, Afonine PV, Schlicksup CJ, Croll TI, Millán C, Richardson JS, Read RJ, Adams PD. Terwilliger TC, et al. Among authors: millan c. Nat Methods. 2022 Nov;19(11):1376-1382. doi: 10.1038/s41592-022-01645-6. Epub 2022 Oct 20. Nat Methods. 2022. PMID: 36266465 Free PMC article.
Putting AlphaFold models to work with phenix.process_predicted_model and ISOLDE.
Oeffner RD, Croll TI, Millán C, Poon BK, Schlicksup CJ, Read RJ, Terwilliger TC. Oeffner RD, et al. Among authors: millan c. Acta Crystallogr D Struct Biol. 2022 Nov 1;78(Pt 11):1303-1314. doi: 10.1107/S2059798322010026. Epub 2022 Oct 27. Acta Crystallogr D Struct Biol. 2022. PMID: 36322415 Free PMC article.
Likelihood-based docking of models into cryo-EM maps.
Millán C, McCoy AJ, Terwilliger TC, Read RJ. Millán C, et al. Acta Crystallogr D Struct Biol. 2023 Apr 1;79(Pt 4):281-289. doi: 10.1107/S2059798323001602. Epub 2023 Mar 15. Acta Crystallogr D Struct Biol. 2023. PMID: 36920336 Free PMC article.
166 results