Anita Orendt
Anita Orendt
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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
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
Quantum mechanically derived AMBER‐compatible heme parameters for various states of the cytochrome P450 catalytic cycle
K Shahrokh, A Orendt, GS Yost, TE Cheatham III
Journal of computational chemistry 33 (2), 119-133, 2012
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
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
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
Tedanolide C:  A Potent New 18-Membered-Ring Cytotoxic Macrolide Isolated from the Papua New Guinea Marine Sponge Ircinia sp.
C Chevallier, TS Bugni, X Feng, MK Harper, AM Orendt, CM Ireland
The Journal of organic chemistry 71 (6), 2510-2513, 2006
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
Macrocyclic helix‐threading peptides for targeting RNA
M Krishnamurthy, K Simon, AM Orendt, PA Beal
Angewandte Chemie International Edition 46 (37), 7044-7047, 2007
Metal Cation−Methyl Interactions in CB11Me12- Salts of Me3Ge+, Me3Sn+, and Me3Pb+
I Zharov, TC Weng, AM Orendt, DH Barich, J Penner-Hahn, DM Grant, ...
Journal of the American Chemical Society 126 (38), 12033-12046, 2004
The nature of the phosphorus-phosphorus double bond as studied by solid-state NMR
KW Zilm, GG Webb, AH Cowley, M Pakulski, A Orendt
Journal of the American Chemical Society 110 (7), 2032-2038, 1988
Measurement of 13C chemical shift tensor principal values with a magic-angle turning experiment
JZ Hu, AM Orendt, DW Alderman, RJ Pugmire, C Ye, DM Grant
Solid State Nuclear Magnetic Resonance 3 (4), 181-197, 1994
Reconciliation of chemical, enzymatic, spectroscopic and computational data to assign the absolute configuration of the DNA base lesion spiroiminodihydantoin
AM Fleming, AM Orendt, Y He, J Zhu, RK Dukor, CJ Burrows
Journal of the American Chemical Society 135 (48), 18191-18204, 2013
Characterization of macromolecular structure elements from a Green River oil shale, I. Extracts
MS Solum, CL Mayne, AM Orendt, RJ Pugmire, J Adams, TH Fletcher
Energy & fuels 28 (1), 453-465, 2014
Solid-state effects on NMR chemical shifts
AM Orendt, JC Facelli
Annual Reports on Nmr Spectroscopy 62, 115-178, 2007
Carbon-13 Shift Tensors in Polycyclic Aromatic Compounds. 8. A Low-Temperature NMR Study of Coronene and Corannulene
AM Orendt, JC Facelli, S Bai, A Rai, M Gossett, LT Scott, J Boerio-Goates, ...
The Journal of Physical Chemistry A 104 (1), 149-155, 2000
Carbonates, Thiocarbonates, and the Corresponding Monoalkyl Derivatives. 1. Their Preparation and Isotropic 13C NMR Chemical Shifts
D Stueber, D Patterson, CL Mayne, AM Orendt, DM Grant, RW Parry
Inorganic Chemistry 40 (8), 1902-1911, 2001
Low-temperature carbon-13 magnetic resonance in solids. 5. Chemical shielding anisotropy of the 13CH2 group
JC Facelli, AM Orendt, AJ Beeler, MS Solum, G Depke, KD Malsch, ...
Journal of the American Chemical Society 107 (24), 6749-6754, 1985
Low temperature 13C NMR magnetic resonance in solids 4. Cyclopropane, bicyclo [1.1. 0] butane and [1.1. 1] propellane
AM Orendt, JC Facelli, DM Grant, J Michl, FH Walker, WP Dailey, ...
Theoretica chimica acta 68 (6), 421-430, 1985
Low-temperature carbon-13 magnetic resonance. 8. Chemical shielding anisotropy of olefinic carbons
AM Orendt, JC Facelli, AJ Beeler, K Reuter, WJ Horton, P Cutts, DM Grant, ...
Journal of the American Chemical Society 110 (11), 3386-3392, 1988
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