Zobrazeno 1 - 10
of 19
pro vyhledávání: '"J G Vinter"'
Autor:
Tracey Cooke, I. M. Buck, Laurence Wright, Atul Kotecha, S. Barret Kalindjian, Nigel P Shankley, Julia R Cushnir, Michael John Pether, C. M. R. Low, J G Vinter
Publikováno v:
Journal of Medicinal Chemistry. 48:6790-6802
A new molecular modeling approach has been used to derive a pharmacophore of the potent and selective cholecystokinin-2 (CCK(2)) receptor antagonist 5 (JB93182), based on features shared with two related series. The technique uses "field points" as s
Publikováno v:
Tetrahedron Letters. 36:7757-7760
Calculations demonstrate that the preferred shape of oxyallyls in ring systems depends on the ring size, consistent with experimentally observed stereoselectivity in cycloadditions to furan. For nine-membered rings, the U-configuration is preferred.
Publikováno v:
Acta Crystallographica Section B Structural Science. 50:382-395
Crystallographic results derived from the Cambridge Structural Database (CSD) have been used to perform a systematic conformational analysis for methylenecycloheptane, oxocycloheptane, azocycloheptane, oxepane, azepane and for the e-lactone and e-lac
Publikováno v:
Journal of Computational Chemistry. 13:693-703
A hybrid conformational search algorithm (DMC) is described that combines a modified form of molecular dynamics with Metropolis Monte Carlo sampling, using the COSMIC(90) force field. Trial configurations are generated by short bursts of high-tempera
Autor:
J. G. Vinter, M. R. Saunders
Publikováno v:
Ciba Foundation Symposium 158-Host-Guest Molecular Interactions: From Chemistry to Biology
Host-guest interactions can be modelled as a non-bonding recognition process using long-range electrostatic forces. By using molecular isopotential maps the differences between the methotrexate-dihydrofolate reductase and folate-dihydrofolate reducta
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c2d39f515e1ae34fd2996169494e7bab
https://doi.org/10.1002/9780470514085.ch16
https://doi.org/10.1002/9780470514085.ch16
Publikováno v:
Chemistry (Weinheim an der Bergstrasse, Germany). 7(16)
The chemical double mutant cycle approach has been used to investigate substituent effects on intermolecular interactions between aromatic rings and pentafluorophenyl pi-systems. The complexes have been characterised using 1H and 19F NMR titrations,
Publikováno v:
Acta crystallographica. Section B, Structural science. 50
The crystal and molecular structures of 11 6-substituted pyridazinone derivatives: 6-phenyl-3(2H)-pyridazinone-acetic acid (1/1) (1), 6-(4-aminophenyl)- 3(2H)-pyridazinone (2), 6-(4-aminophenyl)- 5-methyl-3(2H)-pyridazinone (3), 6-(4-acetamidophenyl)
Autor:
J G, Vinter, M R, Saunders
Publikováno v:
Ciba Foundation symposium. 158
Host-guest interactions can be modelled as a non-bonding recognition process using long-range electrostatic forces. By using molecular isopotential maps the differences between the methotrexate-dihydrofolate reductase and folate-dihydrofolate reducta
Autor:
M. Harris, J. G. Vinter
Publikováno v:
ChemInform. 21
Publikováno v:
Journal of Molecular Graphics. 10:52-53