| Year |
Citation |
Score |
| 2006 |
Fey N, Howell JA, Lovatt JD, Yates PC, Cunningham D, McArdle P, Gottlieb HE, Coles SJ. A molecular mechanics approach to mapping the conformational space of diaryl and triarylphosphines. Dalton Transactions (Cambridge, England : 2003). 5464-75. PMID 17117216 DOI: 10.1039/B610123B |
0.654 |
|
| 2006 |
Fey N, Howell JAS, Lovatt JD, Yates PC, Cunningham D, McArdle P, Gottlieb HE, Coles SJ. A molecular mechanics approach to mapping the conformational space of diaryl and triarylphosphines Dalton Transactions. 5464-5475. DOI: 10.1039/b610123b |
0.554 |
|
| 2002 |
Howell JAS, Yates PC, Fey N, McArdle P, Cunningham D, Parsons S, Rankin DWH. Molecular mechanics analysis of structure and diastereoselectivity toward lithiation in amido- and α-aminoferrocene complexes Organometallics. 21: 5272-5286. DOI: 10.1021/Om020556Q |
0.624 |
|
| 2001 |
Morrison CA, Bone SF, Rankin DWH, Robertson HE, Parsons S, Coxall RA, Fraser S, Howell JAS, Yates PC, Fey N. Conformational properties of substituted ferrocenes: Experimental and theoretical studies of the molecular structures of 1,1′-di-tert-butylferrocene and isopropylferrocene Organometallics. 20: 2309-2320. DOI: 10.1021/Om001012W |
0.609 |
|
| 1999 |
Howell JAS, Fey N, Lovatt JD, Yates PC, McArdle P, Cunningham D, Sadeh E, Gottlieb HE, Goldschmidt Z, Hursthouse MB, Light ME. Effect of fluorine and trifluoromethyl substitution on the donor properties and stereodynamical behaviour of triarylphosphines Journal of the Chemical Society - Dalton Transactions. 3015-3028. DOI: 10.1039/A903211H |
0.585 |
|
| 1996 |
Howell JAS, Yates PC, Ashford NF, Dixon DT, Warren R. Kinetics and mechanism of ligand substitution in [Cr(π-ligand)(CO)3] complexes (ligand = naphthalene, pyrene, thiophene, 2,6-dimethylpyridine, or cycloheptatriene) and of fac/mer isomerization in [M(CO)3L3](M = Cr, Mo or W; L = phosphite, phosphine or isocyanide) Journal of the Chemical Society-Dalton Transactions. 3959-3966. DOI: 10.1039/Dt9960003959 |
0.325 |
|
| 1996 |
Yates PC, Richardson CM. Molecular mechanics calculations on macrocyclic compounds: Conformational studies of cyclododecane and related crown compounds Journal of Molecular Structure: Theochem. 363: 17-22. DOI: 10.1016/0166-1280(96)04398-9 |
0.346 |
|
| 1995 |
Yates PC, Neal T. Theoretical studies of anti-HIV 1H,3H-thiazolo[3,4-a]benzimidazoles Journal of Molecular Structure: Theochem. 334: 187-192. DOI: 10.1016/0166-1280(94)04029-R |
0.316 |
|
| 1995 |
Howell JAS, O'Leary PJ, Yates PC, Goldschmidt Z, Gottlieb HE, Hezroni-Langerman D. Acyclic O- and N-substituted pentadienyl cations: Structural characterisation, cyclisation and computational results Tetrahedron. 51: 7231-7246. DOI: 10.1016/0040-4020(95)00369-J |
0.346 |
|
| 1994 |
Yates PC. Use of the MM2 force field to model palladium complexes with nitrogen-containing aromatic ligands Journal of Molecular Structure: Theochem. 303: 55-64. DOI: 10.1016/0166-1280(94)80173-8 |
0.387 |
|
| 1994 |
Yates PC, Patel B. Semiempirical molecular orbital calculations on dye molecules Journal of Molecular Structure: Theochem. 315: 117-122. DOI: 10.1016/0166-1280(94)03786-K |
0.353 |
|
| 1994 |
Yates PC, Marsden AK. A modified MM2 program for molecular mechanics calculations on coordination compounds Computers and Chemistry. 18: 89-94. DOI: 10.1016/0097-8485(94)85001-1 |
0.369 |
|
| 1993 |
Yates PC. Molecular mechanics and semiempirical molecular orbital calculations on zinc complexes with amino acid derivatives Journal of Molecular Structure: Theochem. 281: 275-282. DOI: 10.1016/0166-1280(93)87084-Q |
0.378 |
|
| 1993 |
Yates PC, Kirby SV. Molecular mechanics analysis of the conformations of thymidine and implications for the design of anti-AIDS drugs Structural Chemistry. 4: 299-302. DOI: 10.1007/Bf00681203 |
0.386 |
|
| 1992 |
Yates PC, Hill TJ, Kaur M. A molecular modelling study of the anti-viral agent amantadine and its derivatives Journal of Molecular Structure: Theochem. 258: 299-313. DOI: 10.1016/0166-1280(92)85072-S |
0.368 |
|
| 1992 |
Yates PC, Patel ST. Molecular mechanics and molecular orbital calculations on halogenated derivatives of thymidine exhibiting anti-viral activity Journal of Molecular Structure: Theochem. 276: 149-158. DOI: 10.1016/0166-1280(92)80029-L |
0.41 |
|
| 1991 |
Yates PC, Drew MGB, Trocha-Grimshaw J, McKillop KP, Nelson SM, Ndifon PT, McAuliffe CA, Nelson J. Electrochemical and X-ray crystallographic studies on three macrocyclic dicopper(I) complexes Journal of the Chemical Society, Dalton Transactions. 1973-1979. DOI: 10.1039/Dt9910001973 |
0.34 |
|
| 1991 |
Yates PC, Mccall CJ, Stevens MF. Structural studies on benzothiazoles. Crystal and molecular structure of 5,6-dimethoxy-2-(4-methoxyphenyl-benzothiazole and molecular orbital calculations on related compounds. Tetrahedron. 47: 6493-6502. DOI: 10.1016/S0040-4020(01)86576-5 |
0.405 |
|
| 1990 |
Harding C, McDowell D, Nelson J, Raghunathan S, Stevenson C, Drew MGB, Yates PC. Single-atom 2 bonds on the lefhand side signNCS bridging in binuclear complexes of MnII, FeII, CoII, NiII, and CuII of macrocyclic 20- and 22-membered ligands: A spectroscopic, crystallographic, and molecular mechanics study Journal of the Chemical Society, Dalton Transactions. 2521-2533. DOI: 10.1039/Dt9900002521 |
0.381 |
|
| 1989 |
Drew MGB, Yates PC. Molecular graphics investigation of macrocyclic complexes Pure and Applied Chemistry. 61: 835-840. DOI: 10.1351/Pac198961050835 |
0.394 |
|
| 1988 |
Drew MGB, Yates PC, Esho FS, Trocha-Grimshaw J, Lavery A, McKillop KP, Nelson SM, Nelson J. Dicopper(II) complexes of a binucleating N4 macrocycle containing mono- and di-atomic bridges; Magnetic interactions mediated by alkoxo- and diaza-bridging ligands. Crystal structures of [Cu2(L1)(pz)2][ClO4]2, [Cu2(L1)(OEt)2(NCS)2]... Journal of the Chemical Society, Dalton Transactions. 2995-3003. DOI: 10.1039/Dt9880002995 |
0.332 |
|
| 1988 |
Nelson J, Murphy BP, Drew MGB, Yates PC, Nelson SM. Binucleating N6 24- and 26-membered macrocyclic ligands. Part 2. Transition-metal homo- and hetero-binuclear complexes: X-ray crystallographic structure determination of a lead-manganese heterobinuclear complex Journal of the Chemical Society, Dalton Transactions. 1001-1010. DOI: 10.1039/Dt9880001001 |
0.347 |
|
| 1988 |
Drew MGB, Yates PC, Troch-Grimshaw J, Lavery A, McKillop KP, Nelson SM, Nelson J. Dicopper(I) complexes containing intramolecular 1,2-diaza bridging ligands. Behaviour of the dicopper site in the dehydrogenation of hydrazobenzene. Crystal structure of [Cu2L2(pydz)2][ClO4]2 Journal of the Chemical Society, Dalton Transactions. 347-352. DOI: 10.1039/Dt9880000347 |
0.376 |
|
| 1987 |
Drew MGB, Yates PC. Molecular mechanics studies of a series of dicopper complexes of a 20-membered macrocycle containing differing types of bridges between the metal centres Journal of the Chemical Society, Dalton Transactions. 2563-2572. DOI: 10.1039/Dt9870002563 |
0.354 |
|
| 1987 |
Murphy BP, Nelson J, Nelson SM, Drew MGB, Yates PC. Binucleating N6 24- and 26-membered macrocyclic ligands. Part 1. Dilead complexes: X-ray crystal structure determination of a macrocyclic dilead complex containing nitrogen-only bridging thiocyanate Journal of the Chemical Society, Dalton Transactions. 123-127. DOI: 10.1039/Dt9870000123 |
0.377 |
|
| 1986 |
Drew MGB, Rice DA, Bin Silong S, Yates PC. Molecular mechanics studies of the conformation of the macrocycle β-2,12-dimethyl-3,7,11,17-tetra-azabicyclo[11.3.1]heptadeca-1(17),13,15- triene (L1) in the free state and in a series of nickel complexes. Crystal and molecular structure of L1 Journal of the Chemical Society, Dalton Transactions. 1081-1086. DOI: 10.1039/Dt9860001081 |
0.412 |
|
| 1986 |
DREW MGB, RICE DA, BIN SILONG S, YATES PC. ChemInform Abstract: Molecular Mechanics Studies of the Conformation of the Macrocycle β-2,12-Dimethyl-3,7,11,17-tetra-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene (L1) in the Free State and in a Series of Nickel Complexes. Chemischer Informationsdienst. 17. DOI: 10.1002/Chin.198639076 |
0.396 |
|
| 1986 |
DREW MGB, HOLLIS S, YATES PC. ChemInform Abstract: Studies in the Flexibility of Macrocycle Ligands. Calculation of Macrocycle Cavity Size by Force-field Methods. Chemischer Informationsdienst. 17. DOI: 10.1002/Chin.198601055 |
0.31 |
|
| 1985 |
Drew MGB, Hollis S, Yates PC. Studies in the flexibility of macrocycle ligands. Calculation of macrocycle cavity size by force-field methods. Crystal and molecular structures of [CoLCl][ClO4]2 and [CuL][PF6]2 {L = 2,13-dimethyl-3,6,9,12,18-penta-azabicyclo[12.3.1]octadeca-1(18),14,16-triene} Journal of the Chemical Society, Dalton Transactions. 1829-1834. DOI: 10.1039/Dt9850001829 |
0.41 |
|
| 1985 |
Drew MGB, Yates PC, Trocha-Grimshaw J, McKillop KP, Nelson SM. Oxidative nitrogen ⋯ nitrogen coupling of nitrites at a dicopper site and the structure of a pentanuclear copper-triazolyl complex containing two-co-ordinate and three-co-ordinate copper(I) Journal of the Chemical Society, Chemical Communications. 262-263. DOI: 10.1039/C39850000262 |
0.317 |
|
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