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Mikhailovskii, Oleg, Xue, Yi, Skrynnikov, Nikolai (2019) MD-assisted refinement of X-ray coordinates. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319095576

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Reference TypeJournal (article/letter/editorial)
TitleMD-assisted refinement of X-ray coordinates
JournalActa Crystallographica Section A Foundations and Advances
AuthorsMikhailovskii, OlegAuthor
Xue, YiAuthor
Skrynnikov, NikolaiAuthor
Year2019 (July 20)Volume75
PublisherInternational Union of Crystallography (IUCr)
DOIdoi:10.1107/s0108767319095576Search in ResearchGate
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Mindat Ref. ID8468527Long-form Identifiermindat:1:5:8468527:6
GUID0
Full ReferenceMikhailovskii, Oleg, Xue, Yi, Skrynnikov, Nikolai (2019) MD-assisted refinement of X-ray coordinates. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319095576
Plain TextMikhailovskii, Oleg, Xue, Yi, Skrynnikov, Nikolai (2019) MD-assisted refinement of X-ray coordinates. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319095576
In(2019) Acta Crystallographica Section A Foundations and Advances Vol. 75. International Union of Crystallography (IUCr)

See Also

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Mikhailovskii, Oleg, Xue, Yi, Skrynnikov, Nikolai R. (2019) MD-assisted refinement of X-ray coordinates. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319095977
Mikhailovskii, Oleg, Xue, Yi, Skrynnikov, Nikolai R. (2022) Modeling a unit cell: crystallographic refinement procedure using the biomolecular MD simulation platform Amber. IUCrJ, 9 (1) 114-133 doi:10.1107/s2052252521011891
Borbulevych, Oleg, Westerhoff, Lance (2014) High-performance, quantum mechanics-based macromolecular x-ray refinement. Acta Crystallographica Section A Foundations and Advances, 70. doi:10.1107/s2053273314085532
Mikhailovskii, Oleg, Izmailov, Sergei A., Xue, Yi, Case, David A., Skrynnikov, Nikolai R. (2024) X-ray Crystallography Module in MD Simulation Program Amber 2023. Refining the Models of Protein Crystals. Journal of Chemical Information and Modeling, 64 (1) 18-25 doi:10.1021/acs.jcim.3c01531
Case, David A., Meisburger, Stephen P., Ando, Nozomi (2019) MD simulations of total X-ray scattering in protein crystals. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s010876731909929x
Puschmann, Horst, Dolomanov, Oleg (2018) Accurate hydrogen-atom positions from standard X-ray data: Hirshfeld atom refinement and Olex2. Acta Crystallographica Section A Foundations and Advances, 74. doi:10.1107/s2053273318094603
Mercado, Brandon, Holland, Patrick, Coric, Ilija (2019) Reduction and refinement choices. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319096673
Zhou, Hua (2019) Pushing surface X-ray probes toward mesoscale and ultrafast transient. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319096491
Bhardwaj, Rajni M. (2019) Current status of X-ray powder diffraction in pharmaceutical industry. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319095862
Coates, Leighton (2019) Anomalous X-ray diffraction studies of ion transport in potassium channels. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319099963
Borbulevych, Oleg Y., Westerhoff, Lance M. (2019) Locating H atoms: active-site protomer/tautomer state determination using routine macromolecular X-ray diffraction and BUSTER/DivCon. Acta Crystallographica Section A Foundations and Advances, 75. doi:10.1107/s0108767319096648
 
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