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Volumn 31, Issue 6, 1992, Pages 792-795

A Binary Quinone Receptor

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EID: 33748597066 PISSN: 05700833 EISSN: 15213773 Source Type: Journal
DOI: 10.1002/anie.199207921 Document Type: Article

Times cited : (115)

References (27)

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- All new compounds gave satisfactory spectroscopic and FAB mass spectrometric data.

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- Energy minimizations were carried out with the CHARMm force field
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16
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- Solvent was not included. In our hands, this force field failed to reproduce experimental observations for large supramolecular systems due to inadequacies in the treatment of intermolecular forces [4, 7]. However, for relatively small molecules such as those in Figure 5, the force field seems to give results which are reliable at least in a qualitative sense.

17
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- J. Chem. Soc. Chem. Commun.
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- Geib, S.J.¹ Hirst, S.C.² Vincent, C.³ Hamilton, A.D.⁴

18
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- The pyridyl and isophthaloyl protons relax at different rates. The possibility that this effect causes the lack of cross‐peaks to the pyridyl amide signal cannot be ruled out.

20
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- Because of the large number of variables which must be determined by computer‐assisted curve‐fitting for this system, the errors in the absolute values of the association constants are large (± 50%). However, Hill plots (, IV) of the titration data gave slopes of 1.1 to 1.2 confirming that there is some positive cooperativity.
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- Ein synthetisches allosterisches System mit hoher Kooperativität zwischen polaren und hydrophoben Bindungszentren
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- Schneider, H.‐J.¹ Ruf, D.²

27
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- Changes in the geometry of the offset π‐stacking interaction may also contribute to the change in the chemical shift of the signal due to the isophthaloyl amide protons.

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