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An Accurate Methodology to Identify the Level of Aggregation in Solution by PGSE NMR Measurements: The Case of Half-Sandwich Diamino Ruthenium(II) Salts
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Zuccaccia, D.; Macchioni, A. An Accurate Methodology to Identify the Level of Aggregation in Solution by PGSE NMR Measurements: The Case of Half-Sandwich Diamino Ruthenium(II) Salts. Organometallics 2005, 24, 3476-3486.
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Zuccaccia, D.1
Macchioni, A.2
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38
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Rational design of organoruthenium anticancer compounds
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Gossens, C.; Tavernelli, I.; Rothlisberger, U. Rational design of organoruthenium anticancer compounds. Chimia 2005, 59, 81-84.
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Gossens, C.1
Tavernelli, I.2
Rothlisberger, U.3
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39
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36148951675
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From Enzymatic Catalysis to Anticancer Drugs: QM/MM Car-Parrinello Simulations of Biological Systems
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Naidoo, K. J, Brady, J, Field, M, Gao, J, Hann, M, Eds, Royal Society of Chemistry: Cambridge, U.K, Special
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Colombo, M. C.; Gossens, C.; Tavernelli, I.; Rothlisberger, U. From Enzymatic Catalysis to Anticancer Drugs: QM/MM Car-Parrinello Simulations of Biological Systems. In Modelling Molecular Structure and Reactivity in Biological Systems; Naidoo, K. J., Brady, J., Field, M., Gao, J., Hann, M., Eds.; Royal Society of Chemistry: Cambridge, U.K., 2006; Special Vol. WATOC 2005, pp 85-100.
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Colombo, M.C.1
Gossens, C.2
Tavernelli, I.3
Rothlisberger, U.4
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40
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36148988314
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This corresponds nearly to the most stable conformer found for the isolated p-cymene species in which the dihedral is 62.7° and the i-Pr hydrogen lies in the arene plane
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This corresponds nearly to the most stable conformer found for the isolated p-cymene species in which the dihedral is 62.7° and the i-Pr hydrogen lies in the arene plane.
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41
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10744222449
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Induced-fit recognition of DNA by organometallic complexes wim dynamic stereogenic centers
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Chen, H.; Parkinson, J. A.; Novakova, O.; Bella, J.; Wang, F.; Dawson, A.; Gould, R.; Parsons, S.; Brabec, V.; Sadler, P. J. Induced-fit recognition of DNA by organometallic complexes wim dynamic stereogenic centers. Proc. Natl. Acad. Sci. U.S.A. 2003, 100, 14623-14628.
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Chen, H.1
Parkinson, J.A.2
Novakova, O.3
Bella, J.4
Wang, F.5
Dawson, A.6
Gould, R.7
Parsons, S.8
Brabec, V.9
Sadler, P.J.10
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42
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0037425530
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Highly selective binding of organometallic rumenium ethylenediamine complexes to nucleic acids: Novel recognition mechanism
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Chen, H.; Parkinson, J. A.; Morris, R. E.; Sadler, P. J. Highly selective binding of organometallic rumenium ethylenediamine complexes to nucleic acids: Novel recognition mechanism. J. Am. Chem. Soc. 2003, 125, 173-186.
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Chen, H.1
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Morris, R.E.3
Sadler, P.J.4
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43
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36148938648
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In the absence of explicit solvent we decided neither to investigate the binding energies of the chloro species nor of the deprotonated N3-thymine species as both would involve the high energies of unsolvated negatively charged ligands
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In the absence of explicit solvent we decided neither to investigate the binding energies of the chloro species nor of the deprotonated N3-thymine species as both would involve the high energies of unsolvated negatively charged ligands.
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44
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36148966861
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This observation is not in agreement with the interpretation of a pKa, titration experiment carried out on a reaction mixture of, η6-biphenylRu(en)Cl, and 5′-CMP in which peaks were assigned to Ru-O(PO3)CMP and Ru-N3CMP but no one to Ru-O2CMP. Unfortunately, the same experiment with cytidine could not be performed due to the low concentration of the product (ref 42, An experiment with the pure nucleobase cytosine (as in our calculation) was not performed
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3)CMP and Ru-N3CMP but no one to Ru-O2CMP. Unfortunately, the same experiment with cytidine could not be performed due to the low concentration of the product (ref 42). An experiment with the pure nucleobase cytosine (as in our calculation) was not performed.
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