Year |
Citation |
Score |
2015 |
Jameson CJ, De Dios AC. Theoretical and physical aspects of nuclear shielding Nuclear Magnetic Resonance. 44: 46-75. DOI: 10.1039/9781847553744-00001 |
0.558 |
|
2012 |
de Dios AC, Jameson CJ. Recent Advances in Nuclear Shielding Calculations Annual Reports On Nmr Spectroscopy. 77: 1-80. DOI: 10.1016/B978-0-12-397020-6.00001-5 |
0.569 |
|
2011 |
Alumasa JN, Gorka AP, Casabianca LB, Comstock E, de Dios AC, Roepe PD. The hydroxyl functionality and a rigid proximal N are required for forming a novel non-covalent quinine-heme complex. Journal of Inorganic Biochemistry. 105: 467-75. PMID 20864177 DOI: 10.1016/J.Jinorgbio.2010.08.011 |
0.69 |
|
2009 |
Casabianca LB, Kallgren JB, Natarajan JK, Alumasa JN, Roepe PD, Wolf C, de Dios AC. Antimalarial drugs and heme in detergent micelles: An NMR study. Journal of Inorganic Biochemistry. 103: 745-8. PMID 19223262 DOI: 10.1016/J.Jinorgbio.2009.01.013 |
0.693 |
|
2009 |
Knighton R, Song X, Pike R, De Dios AC, Casabianca L, Eng G. Synthesis and structural determination of two triphenyltin thiosalicylates Journal of Coordination Chemistry. 62: 3110-3116. DOI: 10.1080/00958970903038426 |
0.682 |
|
2008 |
Casabianca LB, An D, Natarajan JK, Alumasa JN, Roepe PD, Wolf C, de Dios AC. Quinine and chloroquine differentially perturb heme monomer-dimer equilibrium. Inorganic Chemistry. 47: 6077-81. PMID 18533646 DOI: 10.1021/Ic800440D |
0.671 |
|
2008 |
Natarajan JK, Alumasa JN, Yearick K, Ekoue-Kovi KA, Casabianca LB, de Dios AC, Wolf C, Roepe PD. 4-N-, 4-S-, and 4-O-chloroquine analogues: influence of side chain length and quinolyl nitrogen pKa on activity vs chloroquine resistant malaria. Journal of Medicinal Chemistry. 51: 3466-79. PMID 18512900 DOI: 10.1021/Jm701478A |
0.665 |
|
2008 |
Wickramasinghe NP, Shaibat MA, Jones CR, Casabianca LB, de Dios AC, Harwood JS, Ishii Y. Progress in 13C and 1H solid-state nuclear magnetic resonance for paramagnetic systems under very fast magic angle spinning. The Journal of Chemical Physics. 128: 052210. PMID 18266415 DOI: 10.1063/1.2833574 |
0.68 |
|
2008 |
Casabianca LB, de Dios AC. Ab initio calculations of NMR chemical shifts. The Journal of Chemical Physics. 128: 052201. PMID 18266406 DOI: 10.1063/1.2816784 |
0.712 |
|
2007 |
Shaibat MA, Casabianca LB, Wickramasinghe NP, Guggenheim S, de Dios AC, Ishii Y. Characterization of polymorphs and solid-state reactions for paramagnetic systems by 13C solid-state NMR and ab initio calculations. Journal of the American Chemical Society. 129: 10968-9. PMID 17705472 DOI: 10.1021/Ja0703980 |
0.7 |
|
2007 |
Eng G, Song X, Zapata A, de Dios AC, Casabianca L, Pike RD. Synthesis, structural and larvicidal studies of some triorganotin 2-(p-chlorophenyl)-3-methylbutyrates Journal of Organometallic Chemistry. 692: 1398-1404. DOI: 10.1016/J.Jorganchem.2006.11.030 |
0.684 |
|
2007 |
Song X, Zapata A, Hoerner J, De Dios AC, Casabianca L, Eng G. Synthesis, larvicidal, QSAR and structural studies of some triorganotin 2,2,3,3-tetramethylcyclopropanecarboxylates Applied Organometallic Chemistry. 21: 545-550. DOI: 10.1002/Aoc.1241 |
0.688 |
|
2006 |
Casabianca LB, de Dios AC. Relationship between NMR shielding and heme binding strength for a series of 7-substituted quinolines. The Journal of Physical Chemistry. A. 110: 7787-92. PMID 16789763 DOI: 10.1021/Jp061320T |
0.666 |
|
2006 |
Casabianca LB, de Dios AC. Interactions between pairs of antimalarial drugs studied by experimental and ab initio (13)C NMR chemical shifts. Magnetic Resonance in Chemistry : Mrc. 44: 276-82. PMID 16477692 DOI: 10.1002/Mrc.1755 |
0.705 |
|
2006 |
Casabianca LB, Faller CM, de Dios AC. Carbon chemical shift tensor components in quinolines and quinoline N-oxides. The Journal of Physical Chemistry. A. 110: 234-40. PMID 16392860 DOI: 10.1021/Jp055372E |
0.696 |
|
2004 |
de Dios AC, Casabianca LB, Kosar A, Roepe PD. Structure of the amodiaquine-FPIX mu oxo dimer solution complex at atomic resolution. Inorganic Chemistry. 43: 8078-84. PMID 15578847 DOI: 10.1021/Ic0489948 |
0.701 |
|
2004 |
De Dios AC, Sears DN, Tycko R. NMR studies of peptide T, an inhibitor of HIV infectivity, in an aqueous environment. Journal of Peptide Science : An Official Publication of the European Peptide Society. 10: 622-30. PMID 15526711 DOI: 10.1002/psc.571 |
0.701 |
|
2004 |
Casabianca LB, De Dios AC. 13C NMR study of the self-association of chloroquine, amodiaquine, and quinine Journal of Physical Chemistry A. 108: 8505-8513. DOI: 10.1021/Jp047361B |
0.721 |
|
2004 |
Manalo MN, De Dios AC. CSGT-DFT calculation of 13C and 15N NMR shielding of the backbone amide group, 13Cα, and 13Cβ in ω-Conotoxin GVIA Journal of Molecular Structure: Theochem. 675: 1-8. DOI: 10.1016/J.Theochem.2003.12.028 |
0.782 |
|
2003 |
Jameson CJ, Sears DN, De Dios AC. The 129Xe nuclear shielding tensor surfaces for Xe interacting with rare gas atoms Journal of Chemical Physics. 118: 2575-2580. DOI: 10.1063/1.1534093 |
0.763 |
|
2003 |
De Dios AC, Tycko R, Ursos LMB, Roepe PD. NMR studies of chloroquine-ferriprotoporphyrin IX complex Journal of Physical Chemistry A. 107: 5821-5825. DOI: 10.1021/Jp0342982 |
0.309 |
|
2002 |
Leed A, DuBay K, Ursos LM, Sears D, De Dios AC, Roepe PD. Solution structures of antimalarial drug-heme complexes. Biochemistry. 41: 10245-55. PMID 12162739 DOI: 10.1021/Bi020195I |
0.73 |
|
2002 |
Jameson CJ, De Dios AC. Xe nuclear magnetic resonance line shapes in nanochannels Journal of Chemical Physics. 116: 3805-3821. DOI: 10.1063/1.1446424 |
0.505 |
|
2002 |
Manalo MN, De Dios AC. An ab initio study of solvent polarity and hydrogen bonding effects on the nitrogen NMR shieldings of N,N-dimethylacetamidine Magnetic Resonance in Chemistry. 40: 781-785. DOI: 10.1002/Mrc.1095 |
0.767 |
|
2000 |
De Dios AC, Walling A, Cameron I, Ratcliffe CI, Ripmeester JA. Alkali metal NMR chemical shielding as a probe of local structure: An experimental and theoretical study of Rb+ in halide lattices Journal of Physical Chemistry A. 104: 908-914. DOI: 10.1021/Jp994043H |
0.312 |
|
2000 |
Manalo MN, De Dios AC, Cammi R. Solvent effects on15N NMR shielding of 1,2,4,5-tetrazine and isomeric tetrazoles: Continuous set gauge transformation calculation using the polarizable continuum model Journal of Physical Chemistry A. 104: 9600-9604. |
0.764 |
|
2000 |
Rich JE, Manalo MN, De Dios AC. 13C chemical shielding tensors in ampicillin and penicillin-V: A theoretical study Journal of Physical Chemistry A. 104: 5837-5842. |
0.776 |
|
1999 |
Jameson CJ, Jameson AK, De Dios AC, Gerald RE, Lim HM, Kostikin P. Application of nuclear shielding surfaces to the fundamental understanding of adsorption and diffusion in microporous solids Acs Symposium Series. 732: 335-348. |
0.465 |
|
1999 |
De Dios AC, Roach JL, Walling AE. The NMR chemical shift: Local geometry effects Acs Symposium Series. 732: 220-239. |
0.332 |
|
1997 |
De Dios AC, Jameson CJ. The 129Xe nuclear shielding surfaces for Xe interacting with linear molecules CO2, N2, and CO Journal of Chemical Physics. 107: 4253-4270. DOI: 10.1063/1.474800 |
0.558 |
|
1996 |
de Dios AC, Oldfield E. Recent progress in understanding chemical shifts. Solid State Nuclear Magnetic Resonance. 6: 101-25. PMID 8784950 DOI: 10.1016/0926-2040(95)01207-9 |
0.48 |
|
1996 |
De Dios AC. Ab initio calculations of the NMR chemical shift Progress in Nuclear Magnetic Resonance Spectroscopy. 29: 229-278. DOI: 10.1016/S0079-6565(96)01029-1 |
0.328 |
|
1995 |
Jameson AK, Jameson CJ, de Dios AC, Oldfield E, Gerald RE, Turner GL. 129Xe Magic-angle spinning spectra of xenon in zeolite NaA direct observation of mixed clusters of co-adsorbed species Solid State Nuclear Magnetic Resonance. 4: 1-12. PMID 7894978 DOI: 10.1016/0926-2040(94)00028-B |
0.595 |
|
1995 |
Laws DD, Le H, de Dios AC, Havlin RH, Oldfield E. A Basis Size Dependence Study of Carbon-13 Nuclear Magnetic Resonance Spectroscopic Shielding in Alanyl and Valyl Fragments: Toward Protein Shielding Hypersurfaces Journal of the American Chemical Society. 117: 9542-9546. DOI: 10.1021/Ja00142A023 |
0.46 |
|
1995 |
Jameson AK, Jameson CJ, de Dios AC, Oldfield E, Gerald RE. Direct observation of distributions of mixed clusters of coadsorbed species in zeolite NaA Studies in Surface Science and Catalysis. 98: 85-86. DOI: 10.1016/S0167-2991(06)81098-0 |
0.586 |
|
1994 |
de Dios AC, Laws DD, Oldfield E. Predicting Carbon-13 Nuclear Magnetic Resonance Chemical Shielding Tensors in Zwitterionic L-Threonine and L-Tyrosine via Quantum Chemistry Journal of the American Chemical Society. 116: 7784-7786. DOI: 10.1021/Ja00096A039 |
0.388 |
|
1994 |
de Dios AC, Oldfield E. Evaluating 19F Chemical Shielding in Fluorobenzenes: Implications for Chemical Shifts in Proteins Journal of the American Chemical Society. 116: 7453-7454. DOI: 10.1021/Ja00095A077 |
0.382 |
|
1994 |
de Dios AC, Jameson CJ. The NMR Chemical Shift: Insight into Structure and Environment Annual Reports On Nmr Spectroscopy. 29: 1-69. DOI: 10.1016/S0066-4103(08)60130-1 |
0.562 |
|
1993 |
de Dios AC, Pearson JG, Oldfield E. Secondary and tertiary structural effects on protein NMR chemical shifts: an ab initio approach. Science (New York, N.Y.). 260: 1491-6. PMID 8502992 DOI: 10.1126/Science.8502992 |
0.48 |
|
1993 |
Laws DD, de Dios AC, Oldfield E. NMR chemical shifts and structure refinement in proteins. Journal of Biomolecular Nmr. 3: 607-12. PMID 8219743 DOI: 10.1007/Bf00174614 |
0.482 |
|
1993 |
Jameson CJ, De Dios AC. The nuclear magnetic shielding as a function of internuclear separation The Journal of Chemical Physics. 98: 2208-2217. DOI: 10.1063/1.464200 |
0.527 |
|
1993 |
de Dios AC, Oldfield E. Methods for computing nuclear magnetic resonance chemical shielding in large systems. Multiple cluster and charge field approaches Chemical Physics Letters. 205: 108-116. DOI: 10.1016/0009-2614(93)85175-N |
0.462 |
|
1992 |
Jameson CJ, De Dios AC. Ab initio calculations of the intermolecular chemical shift in nuclear magnetic resonance in the gas phase and for adsorbed species The Journal of Chemical Physics. 97: 417-434. DOI: 10.1063/1.463586 |
0.592 |
|
1991 |
Jameson CJ, De Dios AC, Jameson AK. The 31P shielding in phosphine The Journal of Chemical Physics. 95: 9042-9053. DOI: 10.1063/1.461183 |
0.542 |
|
1991 |
Jameson CJ, De Dios AC, Jameson AK. Nuclear magnetic shielding of nitrogen in ammonia The Journal of Chemical Physics. 95: 1069-1079. DOI: 10.1063/1.461135 |
0.58 |
|
1990 |
Jameson CJ, De Dios A, Keith Jameson A. Absolute shielding scale for 31P from gas-phase NMR studies Chemical Physics Letters. 167: 575-582. DOI: 10.1016/0009-2614(90)85472-O |
0.532 |
|
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