-
1
-
-
0023288654
-
-
Soroka, K.; Vithanage, R. S.; Phillips, D. A.; Walker, B.; Dasgupta, P. K. Anal. Chem. 1987, 59, 629.
-
(1987)
Anal. Chem
, vol.59
, pp. 629
-
-
Soroka, K.1
Vithanage, R.S.2
Phillips, D.A.3
Walker, B.4
Dasgupta, P.K.5
-
6
-
-
0003579674
-
-
Schulman, S. G, Ed, Wiley: New York
-
Fernandez-Gutierrez, A.; Munoz de la Pena, A. In Molecular Luminescence Spectroscopy. Methods and Application: Part I; Schulman, S. G., Ed.; Wiley: New York, 1985; pp 371-546.
-
(1985)
Molecular Luminescence Spectroscopy. Methods and Application: Part I
, pp. 371-546
-
-
Fernandez-Gutierrez, A.1
Munoz de la Pena, A.2
-
7
-
-
30844460601
-
-
Farruggia G.; Iotti S.; Prodi L.; Montalti M.; Zaccheroni N.; Savage P. B.; Trapani V.; Sale P.; Wolf F. I. J. Am. Chem. Soc. 2006, 128, 344.
-
(2006)
J. Am. Chem. Soc
, vol.128
, pp. 344
-
-
Farruggia, G.1
Iotti, S.2
Prodi, L.3
Montalti, M.4
Zaccheroni, N.5
Savage, P.B.6
Trapani, V.7
Sale, P.8
Wolf, F.I.9
-
8
-
-
0023428225
-
-
Isshiki, K.; Tsuji, F.; Kuwamoto, T.; Nakayama, E. Anal. Chem. 1987, 59, 2491.
-
(1987)
Anal. Chem
, vol.59
, pp. 2491
-
-
Isshiki, K.1
Tsuji, F.2
Kuwamoto, T.3
Nakayama, E.4
-
9
-
-
33846141777
-
-
Firdaus M. L.; Norisuyea K.; Satoa T.; Urushiharaa S.; Nakagawaa Y.; Umetania S.; Sohrina Y. Anal. Chem. Acta 2007, 583, 296.
-
(2007)
Anal. Chem. Acta
, vol.583
, pp. 296
-
-
Firdaus, M.L.1
Norisuyea, K.2
Satoa, T.3
Urushiharaa, S.4
Nakagawaa, Y.5
Umetania, S.6
Sohrina, Y.7
-
11
-
-
9444296051
-
-
(b) Sheats, J. R.; Antoniadis, H.; Hueschen, M.; Leonard, W.; Miller, J.; Moon, R.; Roitman, D.; Stocking, A. Science 1996, 273, 884.
-
(1996)
Science
, vol.273
, pp. 884
-
-
Sheats, J.R.1
Antoniadis, H.2
Hueschen, M.3
Leonard, W.4
Miller, J.5
Moon, R.6
Roitman, D.7
Stocking, A.8
-
20
-
-
0031235649
-
-
Bardez, E.; Devol, I.; Larrey, B.; Valeur, B. J. Phys. Chem. B 1997, 101, 7786.
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 7786
-
-
Bardez, E.1
Devol, I.2
Larrey, B.3
Valeur, B.4
-
21
-
-
0011966364
-
-
Cheatum, C. M.; Heckscher, M. M.; Crim, F. F. Chem. Phys. Lett. 2001, 349, 37.
-
(2001)
Chem. Phys. Lett
, vol.349
, pp. 37
-
-
Cheatum, C.M.1
Heckscher, M.M.2
Crim, F.F.3
-
26
-
-
38349177981
-
-
Szabo, A.; Ostlund, N. S. Modem Quantum Chemistry, revised first edition; McGraw-Hill, Inc.: New York, 1989; Chapter 6.
-
Szabo, A.; Ostlund, N. S. Modem Quantum Chemistry, revised first edition; McGraw-Hill, Inc.: New York, 1989; Chapter 6.
-
-
-
-
27
-
-
84961980477
-
-
Tomasi, J.; Mennucci, B.; Cammi, R. Chem. Rev. 2005, 105, 2999.
-
(2005)
Chem. Rev
, vol.105
, pp. 2999
-
-
Tomasi, J.1
Mennucci, B.2
Cammi, R.3
-
28
-
-
0001157659
-
Time dependent density functional response theory for molecules
-
Chong, D. P, Ed, World Scientific: Singapore
-
Casida, M. Time dependent density functional response theory for molecules. In Recent advances in Density Functional Methods; Chong, D. P., Ed.; World Scientific: Singapore, 1995; Vol. 1, p 155.
-
(1995)
Recent advances in Density Functional Methods
, vol.1
, pp. 155
-
-
Casida, M.1
-
29
-
-
0000287603
-
-
Casida, M. E.; Jamorski, C.; Casida, K. C.; Salahub, D. R. J. Chem. Phys. 1998, 108, 4439.
-
(1998)
J. Chem. Phys
, vol.108
, pp. 4439
-
-
Casida, M.E.1
Jamorski, C.2
Casida, K.C.3
Salahub, D.R.4
-
30
-
-
38349157373
-
-
Frisch, M. J, Trucks, G. W, Schlegel, H. B, Scuseria, G. E, Robb, M. A, Cheeseman, J. R, Montgomery, J. A, Jr, Vreven, T, Kudin, K. N, Burant, J. C, Millam, J. M, Iyengar, S. S, Tomasi, J, Barone, V, Mennucci, B, Cossi, M, Scalmani, G, Rega, N, Petersson, G. A, Nakatsuji, H, Hada, M, Ehara, M, Toyota, K, Fukuda, R, Hasegawa, J, Ishida, M, Nakajima, T, Honda, Y, Kitao, O, Nakai, H, Kiene, M, Li, X, Knox, J. E, Hratchian, H. P, Cross, J. B, Adamo, C, Jaramillo, J, Gomperts, R, Stratmann, R. E, Yazyev, O, Austin, A. J, Cammi, R, Pomelli, C, Ochterski, J. W, Ayala, P. Y, Morokuma, K, Voth, G. A, Salvador, P, Dannenberg, J. J, Zakrzewski, V. G, Dapprich, S, Daniels, A. D, Strain, M. C, Farkas, O, Malick, D. K, Rabuck, A. D, Raghavachari, K, Foresman, J. B, Ortiz, J. V, Cui, Q, Baboul, A. G, Clifford, S, Cioslowski, J, Stefanov, B. B, Liu, G, Liashenko, A, Piskorz, P, Komaromi, I, Martin, R. L, Fox, D. J, Keith, T, Al-La
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Kiene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian 03, revision B.05; Gaussian, Inc.: Pittsburgh, PA, 2003.
-
-
-
-
32
-
-
38349113556
-
-
Molekel 4.3, Fluckiger, P.; Luthi, H.P.; Portmann, S.; Weber, J. Swiss Center for Scientific Computing, Manno (Switzerland), 2000-2002;
-
Molekel 4.3, Fluckiger, P.; Luthi, H.P.; Portmann, S.; Weber, J. Swiss Center for Scientific Computing, Manno (Switzerland), 2000-2002;
-
-
-
-
33
-
-
0034355284
-
An Interactive Molecular Graphic Tool
-
Portmann, S.; Luthi, H. P. MOLEKEL: An Interactive Molecular Graphic Tool. CHIMIA 2000, 54, 766.
-
(2000)
CHIMIA
, vol.54
, pp. 766
-
-
Portmann, S.1
Luthi, H.2
MOLEKEL, P.3
-
34
-
-
0029633186
-
-
Case, D. A.; Pearlman, D. A.; Caldwell, J. W.; Cheatham, T. E.; Ross, W. S., III; Simmerling, C. L.; Darden, T. A.; Merz, K. M.; Stanton, R. V.; Cheng, A. L.; Vincent, J. J.; Crowley, M.; Tsui, V.; Radmer, R. J.; Duan, Y.; Pitera, J.; Massova, I.; Seibel, G. L.; Sing, U. C.; Weiner, P. K.; Kollman, P. A. AMBER 6, University of California, San Francisco, 1999. Pearlman, D. A.; Case, D. A.; Caldwell, J. W.; Ross, W. S.; Cheatham, T. E.; DeBolt, S., III.; Ferguson, D.; Seibel, G.; Kollman, P. A. Comp. Phys. Commun. 1995, 91, 1
-
Case, D. A.; Pearlman, D. A.; Caldwell, J. W.; Cheatham, T. E.; Ross, W. S., III; Simmerling, C. L.; Darden, T. A.; Merz, K. M.; Stanton, R. V.; Cheng, A. L.; Vincent, J. J.; Crowley, M.; Tsui, V.; Radmer, R. J.; Duan, Y.; Pitera, J.; Massova, I.; Seibel, G. L.; Sing, U. C.; Weiner, P. K.; Kollman, P. A. AMBER 6, University of California, San Francisco, 1999. Pearlman, D. A.; Case, D. A.; Caldwell, J. W.; Ross, W. S.; Cheatham, T. E.; DeBolt, S., III.; Ferguson, D.; Seibel, G.; Kollman, P. A. Comp. Phys. Commun. 1995, 91, 1
-
-
-
-
35
-
-
0004016501
-
-
Jorgensen, W. L.; Chandrasekhar, J.; Madura, J. D.; Impey, R. W.; Klein, M. L. J. Chem. Phys. 1983, 79, 926.
-
(1983)
J. Chem. Phys
, vol.79
, pp. 926
-
-
Jorgensen, W.L.1
Chandrasekhar, J.2
Madura, J.D.3
Impey, R.W.4
Klein, M.L.5
-
36
-
-
0029011701
-
-
Cornell, W. D.; Cieplak, P.; Bayly, C. I.; Gould, I. R.; Merz, K. M., Jr.; Ferguson, D. M.; Spellmeyer, D. C.; Fox, T.; Caldwell, J. W.; Kollman, P. J. Am. Chem. Soc. 1995, 117, 5179.
-
(1995)
J. Am. Chem. Soc
, vol.117
, pp. 5179
-
-
Cornell, W.D.1
Cieplak, P.2
Bayly, C.I.3
Gould, I.R.4
Merz Jr., K.M.5
Ferguson, D.M.6
Spellmeyer, D.C.7
Fox, T.8
Caldwell, J.W.9
Kollman, P.10
-
39
-
-
33846823909
-
-
Darden, T.; York, D.; Pedersen, L. J. Chem. Phys. 1993, 98, 10089.
-
(1993)
J. Chem. Phys
, vol.98
, pp. 10089
-
-
Darden, T.1
York, D.2
Pedersen, L.3
-
40
-
-
33646940952
-
-
Ryckaert, J. P.; Ciccotti, G.; Berendsen, H. J. C. J. Comput. Phys. 1977, 23, 327.
-
(1977)
J. Comput. Phys
, vol.23
, pp. 327
-
-
Ryckaert, J.P.1
Ciccotti, G.2
Berendsen, H.J.C.3
-
43
-
-
0000424494
-
-
Banerjee, T.; Saha, N. N. Acta Crystallogr, Sect. C 1986, 42, 1408.
-
(1986)
Acta Crystallogr, Sect. C
, vol.42
, pp. 1408
-
-
Banerjee, T.1
Saha, N.N.2
-
44
-
-
0001462708
-
-
Chou, P.-T.; Wei, C.-Y-.; Wang, C.-R. C.; Hung, F.-T.; Chang, C.-P. J. Phys. Chem. A 1999, 103, 1939.
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 1939
-
-
Chou, P.-T.1
Wei, C.-Y.2
Wang, C.-R.C.3
Hung, F.-T.4
Chang, C.-P.5
-
45
-
-
38349085358
-
-
In the case of ref 32, ab-initio computations gives a positive dimerization standard Gibbs energy of +1.82 kcal/mol for the most stable 7-hydroxyquinoline dimer, whereas the experimental standard Gibbs energy in benzene solution has been reported as -4.2 kcal/mol
-
In the case of ref 32, ab-initio computations gives a positive dimerization standard Gibbs energy of +1.82 kcal/mol for the most stable 7-hydroxyquinoline dimer, whereas the experimental standard Gibbs energy in benzene solution has been reported as -4.2 kcal/mol.
-
-
-
-
48
-
-
0037165704
-
-
Leung, M.-K.; Mandal, A. B.; Wang, C.-C.; Lee, G.-H.; Peng, S.-M.; Cheng, H.-L.; Her, G.-R.; Chao, I.; Lu, H.-F.; Sun, Y.-C.; Shiao, M.-Y.; Chou, P.-T. J. Am. Chem. Soc. 2001, 124, 4287.
-
(2001)
J. Am. Chem. Soc
, vol.124
, pp. 4287
-
-
Leung, M.-K.1
Mandal, A.B.2
Wang, C.-C.3
Lee, G.-H.4
Peng, S.-M.5
Cheng, H.-L.6
Her, G.-R.7
Chao, I.8
Lu, H.-F.9
Sun, Y.-C.10
Shiao, M.-Y.11
Chou, P.-T.12
-
49
-
-
0036143873
-
-
Baraldi, I.; Caselli, M.; Momicchioli, F.; Ponterini, G.; Vanossi, D. Chem. Phys. 2002, 275, 149.
-
(2002)
Chem. Phys
, vol.275
, pp. 149
-
-
Baraldi, I.1
Caselli, M.2
Momicchioli, F.3
Ponterini, G.4
Vanossi, D.5
-
52
-
-
0000457876
-
-
Bach, A.; Coussan, S.; Müller, A.; Leutwyler, A. J. Chem. Phys. 2000, 112, 1192.
-
(2000)
J. Chem. Phys
, vol.112
, pp. 1192
-
-
Bach, A.1
Coussan, S.2
Müller, A.3
Leutwyler, A.4
-
53
-
-
0037071978
-
-
Matsumoto, Y.; Ebata, T.; Mikami, N. J. Phys. Chem. A 2002, 106, 5591.
-
(2002)
J. Phys. Chem. A
, vol.106
, pp. 5591
-
-
Matsumoto, Y.1
Ebata, T.2
Mikami, N.3
-
54
-
-
14044260528
-
-
Krishnakumar, V.; Nagalakshmi, R.; Janaki, P. Spectrochim. Acta Pt. A 2005, 61, 1097.
-
(2005)
Spectrochim. Acta Pt. A
, vol.61
, pp. 1097
-
-
Krishnakumar, V.1
Nagalakshmi, R.2
Janaki, P.3
|