-
5
-
-
6044232040
-
-
C. A. Kemp, J. U. Flanagan, A. J. van Eldik, J. D. Marechal, C. R. Wolf, G. C. Roberts, M. J. Paine, M. J. Sutcliffe, J. Med. Chem. 2004, 47, 5340-5346.
-
(2004)
J. Med. Chem.
, vol.47
, pp. 5340-5346
-
-
Kemp, C.A.1
Flanagan, J.U.2
Van Eldik, A.J.3
Marechal, J.D.4
Wolf, C.R.5
Roberts, G.C.6
Paine, M.J.7
Sutcliffe, M.J.8
-
6
-
-
0035935677
-
-
M. Ridderström, I. Zamora, O. Fjellström, T. B. Andersson, J. Med. Chem. 2001, 44, 4072-4081.
-
(2001)
J. Med. Chem.
, vol.44
, pp. 4072-4081
-
-
Ridderström, M.1
Zamora, I.2
Fjellström, O.3
Andersson, T.B.4
-
7
-
-
0038440502
-
-
I. Zamora, L. Afzelius, G. Cruciani, J. Med. Chem. 2003, 46, 2313-2324.
-
(2003)
J. Med. Chem.
, vol.46
, pp. 2313-2324
-
-
Zamora, I.1
Afzelius, L.2
Cruciani, G.3
-
8
-
-
0037413558
-
-
J. Venhorst, A. M. ter Laak, J. N. Commandeur, Y. Funae, T. Hiroi, N. P. Vermeulen, J. Med. Chem. 2003, 46, 74-86.
-
(2003)
J. Med. Chem.
, vol.46
, pp. 74-86
-
-
Venhorst, J.1
Ter Laak, A.M.2
Commandeur, J.N.3
Funae, Y.4
Hiroi, T.5
Vermeulen, N.P.6
-
9
-
-
0037046521
-
-
M. J. de Groot, A. A. Alex, B. C. Jones, J. Med. Chem. 2002, 45, 1983-1993.
-
(2002)
J. Med. Chem.
, vol.45
, pp. 1983-1993
-
-
De Groot, M.J.1
Alex, A.A.2
Jones, B.C.3
-
10
-
-
0033529017
-
-
M. J. de Groot, M. J. Ackland, V. A. Horne, A. A. Alex, B. C. Jones, J. Med. Chem. 1999, 42, 1515-1524.
-
(1999)
J. Med. Chem.
, vol.42
, pp. 1515-1524
-
-
De Groot, M.J.1
Ackland, M.J.2
Horne, V.A.3
Alex, A.A.4
Jones, B.C.5
-
11
-
-
3242755090
-
-
D. F. Lewis, B. G. Lake, M. Dickins, P. S. Goldfarb, Xenobiotica 2004, 34, 549-569.
-
(2004)
Xenobiotica
, vol.34
, pp. 549-569
-
-
Lewis, D.F.1
Lake, B.G.2
Dickins, M.3
Goldfarb, P.S.4
-
12
-
-
0036686784
-
-
J. Zuegge, U. Fechner, O. Roche, N. J. Parrott, O. Engkvist, G. Schneider, Quant. Struct.-Act. Relat. 2002, 21, 249-256.
-
(2002)
Quant. Struct.-Act. Relat.
, vol.21
, pp. 249-256
-
-
Zuegge, J.1
Fechner, U.2
Roche, O.3
Parrott, N.J.4
Engkvist, O.5
Schneider, G.6
-
15
-
-
0042357537
-
-
S. Ekins, J. Berbaum, R. K. Harrison, Drug Metab. Dispos. 2003, 37, 1077-1080.
-
(2003)
Drug Metab. Dispos.
, vol.37
, pp. 1077-1080
-
-
Ekins, S.1
Berbaum, J.2
Harrison, R.K.3
-
16
-
-
4043096341
-
-
P. Crivori, I. Zamora, B. Speed, C. Orrenius, I. Poggesi, J. Comput.-Aided Mol. Des. 2004, 18, 155-166.
-
(2004)
J. Comput.-Aided Mol. Des.
, vol.18
, pp. 155-166
-
-
Crivori, P.1
Zamora, I.2
Speed, B.3
Orrenius, C.4
Poggesi, I.5
-
17
-
-
0037389628
-
-
S. Ekins, D. M. Stresser, J. A. Williams, Trends Pharmacol. Sci. 2003, 24, 161-166.
-
(2003)
Trends Pharmacol. Sci.
, vol.24
, pp. 161-166
-
-
Ekins, S.1
Stresser, D.M.2
Williams, J.A.3
-
18
-
-
0032849040
-
-
S. Ekins, G. Bravi, S. Binkley, J. S. Gillespie, B. J. Ring, J. H. Wikel, S. A. Wrighton, Pharmacogenetics 1999, 9, 477-489.
-
(1999)
Pharmacogenetics
, vol.9
, pp. 477-489
-
-
Ekins, S.1
Bravi, G.2
Binkley, S.3
Gillespie, J.S.4
Ring, B.J.5
Wikel, J.H.6
Wrighton, S.A.7
-
21
-
-
0344254815
-
-
V. V. Zernov, K. V. Balakin, A. A. Ivaschenko, N. P. Savchuk, I. V. Pletnev, J. Chem. Inf. Comput. Sci. 2003, 43, 2048-2056.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 2048-2056
-
-
Zernov, V.V.1
Balakin, K.V.2
Ivaschenko, A.A.3
Savchuk, N.P.4
Pletnev, I.V.5
-
22
-
-
0345548661
-
-
E. Byvatov, U. Fechner, J. Sadowski, G. Schneider, J. Chem. Inf. Comput. Sci. 2003, 43, 1882-1889.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 1882-1889
-
-
Byvatov, E.1
Fechner, U.2
Sadowski, J.3
Schneider, G.4
-
23
-
-
0037365194
-
-
M. K. Warmuth, J. Liao, G. Ratsch, M. Mathieson, S. Putta, C. Lemmen, J. Chem. Inf. Comput. Sci. 2003, 43, 667-673.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 667-673
-
-
Warmuth, M.K.1
Liao, J.2
Ratsch, G.3
Mathieson, M.4
Putta, S.5
Lemmen, C.6
-
27
-
-
0035272287
-
-
K.-R. Müller, S. Mika, G. Rätsch, K. Tsuda, B. Schölkopf, IEEE T. Neural Networks 2001, 12, 181-202.
-
(2001)
IEEE T. Neural Networks
, vol.12
, pp. 181-202
-
-
Müller, K.-R.1
Mika, S.2
Rätsch, G.3
Tsuda, K.4
Schölkopf, B.5
-
28
-
-
0003074296
-
-
M. A. Hearst, S. T. Dumais, E. Osuna, J. Platt, B. Schölkopf, IEEE Intell. Syst. 1998, 13, 18-28.
-
(1998)
IEEE Intell. Syst.
, vol.13
, pp. 18-28
-
-
Hearst, M.A.1
Dumais, S.T.2
Osuna, E.3
Platt, J.4
Schölkopf, B.5
-
32
-
-
0032970480
-
-
G. C. Moody, S. J. Griffin, A. N. Mather, D. F. McGinnity, R. J. Riley, Xenobiotica 1999, 29, 53-75.
-
(1999)
Xenobiotica
, vol.29
, pp. 53-75
-
-
Moody, G.C.1
Griffin, S.J.2
Mather, A.N.3
McGinnity, D.F.4
Riley, R.J.5
-
34
-
-
15244346966
-
-
Chemical Computing Group, Montreal, Canada
-
MOE release 2003.2, Chemical Computing Group, Montreal, Canada.
-
MOE Release 2003.2
-
-
-
35
-
-
85192679413
-
-
Molecular Discovery Ltd., London, UK
-
VolSurf version 3.0.11, Molecular Discovery Ltd., London, UK.
-
VolSurf Version 3.0.11
-
-
-
36
-
-
0034625096
-
-
G. Cruciani, P. A. Carrupt, B. Testa, J. Mol. Struct. (THEOCHEM) 2000, 503, 17-30.
-
(2000)
J. Mol. Struct. (THEOCHEM)
, vol.503
, pp. 17-30
-
-
Cruciani, G.1
Carrupt, P.A.2
Testa, B.3
-
37
-
-
15244354193
-
-
Molecular Networks GmbH, Erlangen, Germany
-
CORINA version 3.1, Molecular Networks GmbH, Erlangen, Germany.
-
CORINA Version 3.1
-
-
-
38
-
-
85192681186
-
-
University of Erlangen, Erlangen, Germany (This version is provided as part of Materials Studio 2.2.1 by Accelrys, Inc.)
-
T. Clark, A. Alex, B. Beck, F. Burkhardt, J. Chandrasekhar, P. Gedeck, A. Horn, M. C. Hutter, B. Martin, G. Rauhut, W. Sauer, T. Schindler, T. Steineke, University of Erlangen, Erlangen, Germany (This version is provided as part of Materials Studio 2.2.1 by Accelrys, Inc.).
-
-
-
Clark, T.1
Alex, A.2
Beck, B.3
Burkhardt, F.4
Chandrasekhar, J.5
Gedeck, P.6
Horn, A.7
Hutter, M.C.8
Martin, B.9
Rauhut, G.10
Sauer, W.11
Schindler, T.12
Steineke, T.13
-
39
-
-
0842341771
-
-
M. J. S. Dewar, E. G. Zoebisch, E. F. Healy, J. J. P. Stewart, J. Am. Chem. Soc. 1985, 107, 3902-3909.
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 3902-3909
-
-
Dewar, M.J.S.1
Zoebisch, E.G.2
Healy, E.F.3
Stewart, J.J.P.4
-
43
-
-
0033931867
-
-
P. Baldi, S. Brunak, Y. Chauvin, C. A. Andersen, H. Nielsen, Bioinformatics 2000, 16, 412-424.
-
(2000)
Bioinformatics
, vol.16
, pp. 412-424
-
-
Baldi, P.1
Brunak, S.2
Chauvin, Y.3
Andersen, C.A.4
Nielsen, H.5
-
47
-
-
1942455361
-
-
K. Ito, H. S. Brown, J. B. Houston, Br. J. Clin. Pharmacol. 2004, 57, 473-486.
-
(2004)
Br. J. Clin. Pharmacol.
, vol.57
, pp. 473-486
-
-
Ito, K.1
Brown, H.S.2
Houston, J.B.3
-
50
-
-
0037423276
-
-
M. J. Paine, L. A. McLaughlin, J. U. Flanagan, C. A. Kemp, M. J. Sutcliffe, G. C. Roberts, C. R. Wolf, J. Biol. Chem. 2003, 275, 4021-4027.
-
(2003)
J. Biol. Chem.
, vol.275
, pp. 4021-4027
-
-
Paine, M.J.1
McLaughlin, L.A.2
Flanagan, J.U.3
Kemp, C.A.4
Sutcliffe, M.J.5
Roberts, G.C.6
Wolf, C.R.7
-
51
-
-
3442896773
-
-
P. A. Williams, J. Cosme, D. M. Vinković, A. Ward, H. C. Angove, P. J. Day, C. Vonrhein, I. J. Tickle, H. Jhoti, Science 2004, 305, 683-686.
-
(2004)
Science
, vol.305
, pp. 683-686
-
-
Williams, P.A.1
Cosme, J.2
Vinković, D.M.3
Ward, A.4
Angove, H.C.5
Day, P.J.6
Vonrhein, C.7
Tickle, I.J.8
Jhoti, H.9
-
52
-
-
4644301430
-
-
J. K. Yano, M. R. Wester, G. A. Schoch, K. J. Griffin, C. D. Stout, E. F. Johnson, J. Biol. Chem. 2004, 279, 38091-38094.
-
(2004)
J. Biol. Chem.
, vol.279
, pp. 38091-38094
-
-
Yano, J.K.1
Wester, M.R.2
Schoch, G.A.3
Griffin, K.J.4
Stout, C.D.5
Johnson, E.F.6
-
53
-
-
0345117343
-
-
M. J. Sorich, J. O. Miners, R. A. McKinnon, D. A. Winkler, F. R. Burden, P. A. Smith, J. Chem. Inf. Comput. Sci. 2003, 43, 2019-2024.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 2019-2024
-
-
Sorich, M.J.1
Miners, J.O.2
McKinnon, R.A.3
Winkler, D.A.4
Burden, F.R.5
Smith, P.A.6
-
54
-
-
4744373627
-
-
M. J. Sorich, R. A. McKinnon, J. O. Miners, D. A. Winkler, P. A. Smith, J. Med. Chem. 2004, 47, 5311-5317.
-
(2004)
J. Med. Chem.
, vol.47
, pp. 5311-5317
-
-
Sorich, M.J.1
McKinnon, R.A.2
Miners, J.O.3
Winkler, D.A.4
Smith, P.A.5
-
55
-
-
0034721138
-
-
S. Rao, R. Aoyama, M. Schrag, W. F. Trager, A. Rettie, J. P. Jones, J. Med. Chem. 2000, 43, 2789-2796.
-
(2000)
J. Med. Chem.
, vol.43
, pp. 2789-2796
-
-
Rao, S.1
Aoyama, R.2
Schrag, M.3
Trager, W.F.4
Rettie, A.5
Jones, J.P.6
-
56
-
-
12244310480
-
-
L. Afzelius, C. M. Masimirembwa, A. Karlén, T. B. Andersson, I. Zamora, J. Comp.-Aided Mol. Des. 2002, 16, 443-458.
-
(2002)
J. Comp.-Aided Mol. Des.
, vol.16
, pp. 443-458
-
-
Afzelius, L.1
Masimirembwa, C.M.2
Karlén, A.3
Andersson, T.B.4
Zamora, I.5
-
57
-
-
0842304425
-
-
L. Afzelius, I. Zamora, C. M. Masimirembwa, A. Karlén, T. B. Andersson, S. Mecucci, M. Baroni, G. Cruciani, J. Med. Chem. 2004, 47, 907-914.
-
(2004)
J. Med. Chem.
, vol.47
, pp. 907-914
-
-
Afzelius, L.1
Zamora, I.2
Masimirembwa, C.M.3
Karlén, A.4
Andersson, T.B.5
Mecucci, S.6
Baroni, M.7
Cruciani, G.8
-
58
-
-
0000420289
-
-
L. Mu, R. S. Drago, D. E. Richardson, J. Chem. Soc. Perkin Trans. 1998, 2, 159-167.
-
(1998)
J. Chem. Soc. Perkin Trans.
, vol.2
, pp. 159-167
-
-
Mu, L.1
Drago, R.S.2
Richardson, D.E.3
-
60
-
-
0001837407
-
-
G. Schürer, P. Gedeck, M. Gottschalk, T. Clark, Int. J. Quant. Chem. 1999, 75, 17-31.
-
(1999)
Int. J. Quant. Chem.
, vol.75
, pp. 17-31
-
-
Schürer, G.1
Gedeck, P.2
Gottschalk, M.3
Clark, T.4
-
61
-
-
0001669370
-
-
B. Beck, T. Clark, R. C. Glen, J. Comput. Chem. 1997, 18, 744-756.
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 744-756
-
-
Beck, B.1
Clark, T.2
Glen, R.C.3
-
64
-
-
0348050202
-
-
D. T. Cronce, G. R. Famini, J. A. De Soto, L. Y. Wilson, J. Chem. Soc. Perkin Trans. 1998, 2, 1293-1301.
-
(1998)
J. Chem. Soc. Perkin Trans.
, vol.2
, pp. 1293-1301
-
-
Cronce, D.T.1
Famini, G.R.2
De Soto, J.A.3
Wilson, L.Y.4
-
65
-
-
84986435733
-
-
J. L. Pascual-Ahuir, E. Silla, I. Tunon, J. Comput. Chem. 1994, 15, 1127-1138.
-
(1994)
J. Comput. Chem.
, vol.15
, pp. 1127-1138
-
-
Pascual-Ahuir, J.L.1
Silla, E.2
Tunon, I.3
|