| 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 | 578 | 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 | 454 | 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 | 256 | 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 | 187 | 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 | 117 | 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 | 91 | 1996 |
| 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 | 89 | 1988 |
| 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 | 86 | 2006 |
| Macrocyclic helix‐threading peptides for targeting RNA M Krishnamurthy, K Simon, AM Orendt, PA Beal Angewandte Chemie International Edition 46 (37), 7044-7047, 2007 | 80 | 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 | 77 | 2004 |
| 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 | 68 | 2013 |
| 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 | 67 | 1988 |
| 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 | 64 | 2014 |
| Solid-state effects on NMR chemical shifts AM Orendt, JC Facelli Annual Reports on Nmr Spectroscopy 62, 115-178, 2007 | 61 | 2007 |
| 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 | 60 | 1994 |
| 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 | 58 | 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 | 57 | 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 | 50 | 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, 421-430, 1985 | 44 | 1985 |
| Investigation of the Polymorphs of Dimethyl-3,6-Dichloro-2,5-Dihydroxyterephthalate by 13C Solid-State NMR Spectroscopy M Strohmeier, AM Orendt, DW Alderman, DM Grant Journal of the American Chemical Society 123 (8), 1713-1722, 2001 | 41 | 2001 |
