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JC Facelli
JC Facelli
Distinguished Professor of Biomedical Informatics
Verifierad e-postadress på utah.edu
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Report on the sixth blind test of organic crystal structure prediction methods
AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ...
Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016
5782016
A third blind test of crystal structure prediction
GM Day, WDS Motherwell, HL Ammon, SXM Boerrigter, RG Della Valle, ...
Acta Crystallographica Section B: Structural Science 61 (5), 511-527, 2005
5262005
Significant progress in predicting the crystal structures of small organic molecules–a report on the fourth blind test
GM Day, TG Cooper, AJ Cruz-Cabeza, KE Hejczyk, HL Ammon, ...
Acta Crystallographica Section B: Structural Science 65 (2), 107-125, 2009
4722009
Towards crystal structure prediction of complex organic compounds–a report on the fifth blind test
DA Bardwell, CS Adjiman, YA Arnautova, E Bartashevich, SXM Boerrigter, ...
Acta Crystallographica Section B: Structural Science 67 (6), 535-551, 2011
4542011
The National COVID Cohort Collaborative (N3C): rationale, design, infrastructure, and deployment
MA Haendel, CG Chute, TD Bennett, DA Eichmann, J Guinney, WA Kibbe, ...
Journal of the American Medical Informatics Association 28 (3), 427-443, 2021
3992021
Development of a definition of postacute sequelae of SARS-CoV-2 infection
T Thaweethai, SE Jolley, EW Karlson, EB Levitan, B Levy, GA McComsey, ...
Jama 329 (22), 1934-1946, 2023
2412023
Low-temperature carbon-13 magnetic resonance in solids. 3. Linear and pseudolinear molecules
AJ Beeler, AM Orendt, DM Grant, PW Cutts, J Michl, KW Zilm, ...
Journal of the American Chemical Society 106 (25), 7672-7676, 1984
1871984
Clinical characterization and prediction of clinical severity of SARS-CoV-2 infection among US adults using data from the US National COVID Cohort Collaborative
TD Bennett, RA Moffitt, JG Hajagos, B Amor, A Anand, MM Bissell, ...
JAMA network open 4 (7), e2116901-e2116901, 2021
1852021
Chemical shift tensors: Theory and application to molecular structural problems
JC Facelli
Progress in nuclear magnetic resonance spectroscopy 58 (3-4), 176, 2011
1472011
Determination of molecular symmetry in crystalline naphthalene using solid-state NMR
JC Facelli, DM Grant
Nature 365 (6444), 325-327, 1993
1291993
Vibrational and electronic spectra of matrix-isolated nitrogen trimer radical and azide
R Tian, JC Facelli, J Michl
The Journal of Physical Chemistry 92 (14), 4073-4079, 1988
1271988
15N chemical shift principal values in nitrogen heterocycles
MS Solum, KL Altmann, M Strohmeier, DA Berges, Y Zhang, JC Facelli, ...
Journal of the American Chemical Society 119 (41), 9804-9809, 1997
1261997
Calculations of chemical shieldings: Theory and applications
JC Facelli
Concepts in Magnetic Resonance Part A: An Educational Journal 20 (1), 42-69, 2004
1222004
Three-dimensional structure of the Siskin Green River Oil Shale Kerogen Model: a comparison between calculated and observed properties
AM Orendt, ISO Pimienta, SR Badu, MS Solum, RJ Pugmire, JC Facelli, ...
Energy & Fuels 27 (2), 702-710, 2013
1172013
A review of the applications of data mining and machine learning for the prediction of biomedical properties of nanoparticles
DE Jones, H Ghandehari, JC Facelli
Computer methods and programs in biomedicine 132, 93-103, 2016
1042016
Modified genetic algorithm to model crystal structures. I. Benzene, naphthalene and anthracene
VE Bazterra, MB Ferraro, JC Facelli
The Journal of Chemical Physics 116 (14), 5984-5991, 2002
1022002
pSCANNER: Patient-centered scalable national network for effectiveness research
L Ohno-Machado, Z Agha, DS Bell, L Dahm, ME Day, JN Doctor, ...
Journal of the American Medical Informatics Association 21 (4), 621-626, 2014
922014
15N chemical shift tensors in nucleic acid bases
JZ Hu, JC Facelli, DW Alderman, RJ Pugmire, DM Grant
Journal of the American Chemical Society 120 (38), 9863-9869, 1998
921998
13C Dipolar NMR Spectrum of Matrix-Isolated o-Benzyne-1, 2-13 C 2
AM Orendt, JC Facelli, JG Radziszewski, WJ Horton, DM Grant, J Michl
Journal of the American Chemical Society 118 (4), 846-852, 1996
911996
Carbon-13 NMR and polarized IR spectra of vicinally labeled cyclobutadiene-13C2 in an argon matrix: interconversion of valence tautomers
AM Orendt, BR Arnold, JG Radziszewski, JC Facelli, KD Malsch, H Strub, ...
Journal of the American Chemical Society 110 (8), 2648-2650, 1988
891988
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Artiklar 1–20