-
2
-
-
0029783934
-
-
D. E. Patterson, R. D. Cramer, A. M. Ferguson, R. D. Clark and L. E. Weinberger, J. Med. Chem., 1996, 39, 3049.
-
(1996)
J. Med. Chem.
, vol.39
, pp. 3049
-
-
Patterson, D.E.1
Cramer, R.D.2
Ferguson, A.M.3
Clark, R.D.4
Weinberger, L.E.5
-
3
-
-
0037068532
-
-
Y. C. Martin, J. L. Kofron and L. M. Traphagen, J. Med. Chem., 2002, 45, 4350.
-
(2002)
J. Med. Chem.
, vol.45
, pp. 4350
-
-
Martin, Y.C.1
Kofron, J.L.2
Traphagen, L.M.3
-
10
-
-
0001696622
-
-
A. Schuffenhauer, V. J. Gillet and P. Willett, J. Chem. Inf. Comput. Sci., 2000, 40, 295.
-
(2000)
J. Chem. Inf. Comput. Sci.
, vol.40
, pp. 295
-
-
Schuffenher, A.1
Gillet, V.J.2
Willett, P.3
-
11
-
-
0037374498
-
-
J. A. DiMasi, R. W. Hansen and H. G. Grabowski, J. Health Econ., 2003, 22, 151.
-
(2003)
J. Health Econ.
, vol.22
, pp. 151
-
-
DiMasi, J.A.1
Hansen, R.W.2
Grabowski, H.G.3
-
12
-
-
10344256963
-
-
http://wwwdb.europarl.eu.int/oeil/oeil_ViewDNL.ProcedureView?lang= 2&procid=4179'.
-
-
-
-
13
-
-
5344244908
-
-
P. Willett, J. M. Barnard and G. M. Downs, J. Chem. Inf. Comput. Sci., 1998, 38, 983.
-
(1998)
J. Chem. Inf. Comput. Sci.
, vol.38
, pp. 983
-
-
Willett, P.1
Barnard, J.M.2
Downs, G.M.3
-
18
-
-
0002606755
-
-
W. P. Walters, M. T. Stahl and M. A. Murcko, Drug Discovery Today, 1998, 3, 160.
-
(1998)
Drug Discovery Today
, vol.3
, pp. 160
-
-
Walters, W.P.1
Stahl, M.T.2
Murcko, M.A.3
-
19
-
-
0032269667
-
-
V. J. Gillet, D. J. Wild, P. Willett and J. Bradshaw, Comput. J., 1998, 41, 547.
-
(1998)
Comput. J.
, vol.41
, pp. 547
-
-
Gillet, V.J.1
Wild, D.J.2
Willett, P.3
Bradshw, J.4
-
23
-
-
0000247432
-
-
M. Johnson, S. Basak and G. Maggiora, Math. Comput. Modell., 1988, 11, 630.
-
(1988)
Math. Comput. Modell.
, vol.11
, pp. 630
-
-
Johnson, M.1
Basak, S.2
Maggiora, G.3
-
26
-
-
0003912490
-
-
ed. R. A. Wilson and F. C. Keil, MIT Press, Cambridge, MA
-
R. L. Goldstone, in MIT encyclopaedia of the cognitive sciences, ed. R. A. Wilson and F. C. Keil, MIT Press, Cambridge, MA, 2004.
-
(2004)
MIT Encyclopaedia of the Cognitive Sciences
-
-
Goldstone, R.L.1
-
27
-
-
2942700377
-
-
J. Hert, P. Willett and D. J. Wilton, J. Chem. Inf. Comput. Sci., 2004, 44, 1177.
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 1177
-
-
Hert, J.1
Willett, P.2
Wilton, D.J.3
-
28
-
-
0023751431
-
-
R. D. Cramer, D. E. Patterson and J. D. Bunce, J. Am. Chem. Soc., 1988, 110, 5959.
-
(1988)
J. Am. Chem. Soc.
, vol.110
, pp. 5959
-
-
Cramer, R.D.1
Patterson, D.E.2
Bunce, J.D.3
-
30
-
-
0345731818
-
-
R. Carbo-Dorca and E. Besalu, J. Mol. Struct., THEOCHEM, 1998, 451, 11.
-
(1998)
J. Mol. Struct., THEOCHEM
, vol.451
, pp. 11
-
-
Carbo-Dorca, R.1
Besalu, E.2
-
31
-
-
0034710718
-
-
M. Pastor, G. Cruciani, I. McLay, S. Pickett and S. Clementi, J. Med. Chem., 2000, 43, 3233.
-
(2000)
J. Med. Chem.
, vol.43
, pp. 3233
-
-
Pastor, M.1
Cruciani, G.2
McLay, I.3
Pickett, S.4
Clementi, S.5
-
34
-
-
0016951155
-
-
W. E. Brugger, A. J. Stuper and P. C. Jurs, J. Chem. Inf. Comput. Sci., 1976, 16, 105.
-
(1976)
J. Chem. Inf. Comput. Sci.
, vol.16
, pp. 105
-
-
Brugger, W.E.1
Stuper, A.J.2
Jurs, P.C.3
-
39
-
-
0036249270
-
-
J. D. Holliday, C. Y. Hu and P. Willett, Comb. Chem. High-Throughput Screening, 2002, 5, 155.
-
(2002)
Comb. Chem. High-throughput Screening
, vol.5
, pp. 155
-
-
Holliday, J.D.1
Hu, C.Y.2
Willett, P.3
-
42
-
-
10344246860
-
-
ed. M. G. Ford, D. J. Livingstone, J. Dearden and H. van de Waterbeemd, Prous Science Publishers, Barcelona
-
Y. C. Martin, in Euro QSAR 2002: Designing Drugs and Crop Protectants: Processes, Problems and Solutions, ed. M. G. Ford, D. J. Livingstone, J. Dearden and H. van de Waterbeemd, Prous Science Publishers, Barcelona, 2003.
-
(2003)
Euro QSAR 2002: Designing Drugs and Crop Protectants: Processes, Problems and Solutions
-
-
Martin, Y.C.1
-
45
-
-
0035282627
-
-
K. S. Jandu, V. Barrett, M. Brockwell, D. Cambridge, D. R. Farrant, C. Foster, H. Giles, R. C. Glen, A. P. Hill, H. Hobbs, A. Honey, G. R. Martin, J. Salmon, D. Smith, P. Woollard and D. L. Selwood, J. Med Chem., 2001, 44, 681.
-
(2001)
J. Med Chem.
, vol.44
, pp. 681
-
-
Jandu, K.S.1
Barrett, V.2
Brockll, M.3
Cambridge, D.4
Farrant, D.R.5
Foster, C.6
Giles, H.7
Glen, R.C.8
Hill, A.P.9
Hobbs, H.10
Honey, A.11
Martin, G.R.12
Salmon, J.13
Smith, D.14
Woollard, P.15
Selwood, D.L.16
-
46
-
-
0025903750
-
-
D. J. Livingstone, G. Hesketh and D. Clayworth, J. Mol. Graphics, 1991, 9, 115.
-
(1991)
J. Mol. Graphics
, vol.9
, pp. 115
-
-
Livingstone, D.J.1
Hesketh, G.2
Clayworth, D.3
-
48
-
-
0345548661
-
-
E. Byvatov, U. Fechner, J. Sadowski and G. Schneider, J. Chem. Inf. Comput. Sci., 2003, 43, 1882.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 1882
-
-
Byvatov, E.1
Fechner, U.2
Sadowski, J.3
Schneider, G.4
-
50
-
-
0035438388
-
-
G. Harper, J. Bradshaw, J. C. Gittins, D. V. S. Green and A. R. Leach, J. Chem. Inf. Comput. Sci., 2001, 41, 1295.
-
(2001)
J. Chem. In. Comput. Sci.
, vol.41
, pp. 1295
-
-
Harper, G.1
Bradshaw, J.2
Gittins, J.C.3
Green, D.V.S.4
Leach, A.R.5
-
51
-
-
1842690601
-
-
A. Bender, H. Y. Mussa, R. C. Glen and S. Reiling, J. Chem. Inf. Comput. Sci., 2004, 44, 170.
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 170
-
-
Bender, A.1
Mussa, H.Y.2
Glen, R.C.3
Reiling, S.4
-
52
-
-
5544290537
-
-
A. Bender, H. Y. Mussa, R. C. Glen and S. Reiling, J. Chem. Inf. Comput. Sci., 2004, 44, 1708.
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 1708
-
-
Bender, A.1
Mussa, H.Y.2
Glen, R.C.3
Reiling, S.4
-
54
-
-
0028496956
-
-
G. M. Downs, P. Willett and W. Fisanick, J. Chem. Inf. Comput. Sci., 1994, 34, 1094.
-
(1994)
J. Chem. Inf. Comput. Sci.
, vol.34
, pp. 1094
-
-
Downs, G.M.1
Willett, P.2
Fisanick, W.3
-
56
-
-
0031024171
-
-
C. A. Lipinski, F. Lombarde, B. W. Dominy and P. J. Feeney, Adv. Drug Deliv. Rev., 1997, 23, 3.
-
(1997)
Adv. Drug Deliv. Rev.
, vol.23
, pp. 3
-
-
Lipinski, C.A.1
Lombarde, F.2
Dominy, B.W.3
Feeney, P.J.4
-
68
-
-
0030340218
-
-
G. E. Kellogg, L. B. Kier, P. Gaillard and L. H. Hall, J. Comput.-Aided Mol. Des., 1996, 10, 513.
-
(1996)
J. Comput.-aided Mol. Des.
, vol.10
, pp. 513
-
-
Kellogg, G.E.1
Kier, L.B.2
Gaillard, P.3
Hall, L.H.4
-
69
-
-
0000253451
-
-
M. M. Cone, R. Venkataraghavan and F. W. McLafferty, J. Am. Chem. Soc., 1977, 99, 7668.
-
(1977)
J. Am. Chem. Soc.
, vol.99
, pp. 7668
-
-
Cone, M.M.1
Venkataraghavan, R.2
McLafferty, F.W.3
-
72
-
-
0016381211
-
-
R. D. Cramer, 3rd, G. Redl and C. E. Berkoff, J. Med. Chem., 1974, 17, 533.
-
(1974)
J. Med. Chem.
, vol.17
, pp. 533
-
-
Cramer III, R.D.1
Redl, G.2
Berkoff, C.E.3
-
76
-
-
33751391841
-
-
Y. Takahashi, M. Sukekawa and S. Sasaki, J. Chem. Inf. Comput. Sci., 1992, 32, 639.
-
(1992)
J. Chem. Inf. Comput. Sci.
, vol.32
, pp. 639
-
-
Takahashi, Y.1
Sukekawa, M.2
Sasaki, S.3
-
78
-
-
0038579386
-
-
J. L. Faulon, D. P. Visco, Jr. and R. S. Pophale, J. Chem. Inf. Comput. Sci., 2003, 43, 707.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 707
-
-
Faulon, J.L.1
Visco Jr., D.P.2
Pophale, R.S.3
-
80
-
-
0038512085
-
-
L. Xing, R. C. Glen and R. D. Clark, J. Chem. Inf. Comput. Sci., 2003, 43, 870.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 870
-
-
Xing, L.1
Glen, R.C.2
Clark, R.D.3
-
81
-
-
0035263414
-
-
L. Xue, F. L. Stahura, J. W. Godden and J. Bajorath, J. Chem. Inf. Comput. Sci., 2001, 41, 394.
-
(2001)
J. Chem. Inf. Comput. Sci.
, vol.41
, pp. 394
-
-
Xue, L.1
Stahura, F.L.2
Godden, J.W.3
Bajorath, J.4
-
83
-
-
0033193582
-
-
L. Xue, J. W. Godden and J. Bajorath, J. Chem. Inf. Comput. Sci., 1999, 39, 881.
-
(1999)
J. Chem. Inf. Comput. Sci.
, vol.39
, pp. 881
-
-
Xue, L.1
Godden, J.W.2
Bajorath, J.3
-
87
-
-
84986467774
-
-
P. D. Walker, G. A. Arteca and P. G. Mezey, J. Comput. Chem., 1991, 12, 220.
-
(1991)
J. Comput. Chem.
, vol.12
, pp. 220
-
-
Walker, P.D.1
Arteca, G.A.2
Mezey, P.G.3
-
88
-
-
0001458213
-
-
A. C. Good, E. E. Hodgkin and W. G. Richards, J. Chem. Inf. Comput. Sci., 1992, 32, 188.
-
(1992)
J. Chem. Inf. Comput. Sci.
, vol.32
, pp. 188
-
-
Good, A.C.1
Hodgkin, E.E.2
Richards, W.G.3
-
91
-
-
0042905858
-
-
P. Bultinck, T. Kuppens, X. Girones and R. Carbo-Dorca, J. Chem. Inf. Comput. Sci., 2003, 43, 1143.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 1143
-
-
Bultinck, P.1
Kuppens, T.2
Girones, X.3
Carbo-Dorca, R.4
-
92
-
-
0036001096
-
-
E. Besalu, X. Girones, L. Amat and R. Carbo-Dorca, Acc. Chem. Res., 2002, 35, 289.
-
(2002)
Acc. Chem. Res.
, vol.35
, pp. 289
-
-
Besalu, E.1
Girones, X.2
Amat, L.3
Carbo-Dorca, R.4
-
93
-
-
0035960239
-
-
G. Boon, W. Langenaeker, F. De Proft, H. De Winter, J. P. Tollenaere and P. Geerlings, J. Phys. Chem. A, 2001, 105, 8805.
-
(2001)
J. Phys. Chem. A
, vol.105
, pp. 8805
-
-
Boon, G.1
Langenaeker, W.2
De Proft, F.3
De Winter, H.4
Tollenaere, J.P.5
Geerlings, P.6
-
96
-
-
0003460870
-
-
ed. S. Kotz and N. L. Johnson, Wiley, New York
-
H. Wold, in Encyclopedia of Statistical Sciences (Vol. 6), ed. S. Kotz and N. L. Johnson, Wiley, New York, 1985.
-
(1985)
Encyclopedia of Statistical Sciences
, vol.6
-
-
Wold, H.1
-
97
-
-
0027944195
-
-
G. Klebe, U. Abraham and T. Mietzner, J. Med. Chem., 1994, 37, 4130.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 4130
-
-
Klebe, G.1
Abraham, U.2
Mietzner, T.3
-
99
-
-
10344252539
-
-
The Conformational Parameter in Drug Design: e Active Analog Approach, ed. E. Olson and A. E. Christoffersen, ACS, Washington DC, USA
-
C. R. Marshall, C. D. Barry, H. E. Bosshard, R. A. Dammkoehler and D. A. Dunn, in The Conformational Parameter in Drug Design: The Active Analog Approach, Computer-Assisted Drug Design, ACS Symposium Series 112, ed. E. Olson and A. E. Christoffersen, ACS, Washington DC, USA, 1979.
-
(1979)
Computer-Assi Drug Design, ACS Symposium Series
, vol.112
-
-
Marshall, C.R.1
Barry, C.D.2
Bosshard, H.E.3
Dammkoehler, R.A.4
Dunn, D.A.5
-
100
-
-
0033523672
-
-
G. Schneider, W. Neidhart, T. Giller and G. Schmid, Angew. Chem., Int. Edn. Engl., 1999, 38, 2894.
-
(1999)
Angew. Chem., Int. Edn. Engl.
, vol.38
, pp. 2894
-
-
Schneider, G.1
Neidhart, W.2
Giller, T.3
Schmid, G.4
-
101
-
-
0001639610
-
-
R. P. Sheridan, M. D. Miller, D. J. Underwood and S. K. Kearsley, J. Chem. Inf. Comput. Sci., 1996, 36, 128.
-
(1919)
J. Chem. Inf. Comput. Sci.
, vol.36
, pp. 128
-
-
Sheridan, R.P.1
Miller, M.D.2
Underwood, D.J.3
Kearsley, S.K.4
-
104
-
-
0027357177
-
-
R. Nilakantan, N. Bauman and R. Venkataraghavan, J. Chem. Inf. Comput. Sci., 1993, 33, 79.
-
(1993)
J. Chem. Inf. Comput. Sci.
, vol.33
, pp. 79
-
-
Nilakantan, R.1
Bauman, N.2
Venkataraghavan, R.3
-
105
-
-
0000465937
-
-
S. D. Pickett, J. S. Mason and I. M. McLay, J. Chem. Inf. Comput. Sci., 1996, 36, 1214.
-
(1996)
J. Chem. Inf. Comput. Sci.
, vol.36
, pp. 1214
-
-
Pickett, S.D.1
Mason, J.S.2
McLay, I.M.3
-
106
-
-
0035003352
-
-
J. S. Mason, A. C. Good and E. J. Martin, Curr. Pharm. Des., 2001, 7, 567.
-
(2001)
Curr. Pharm. Des.
, vol.7
, pp. 567
-
-
Mason, J.S.1
Good, A.C.2
Martin, E.J.3
-
108
-
-
0033606988
-
-
J. S. Mason, I. Morize, P. R. Menard, D. L. Cheney, C. Hulme and R. F. Labaudiniere, J. Med. Chem., 1999, 42, 3251.
-
(1999)
J. Med. Chem.
, vol.42
, pp. 3251
-
-
Mason, J.S.1
Morize, I.2
Menard, P.R.3
Cheney, D.L.4
Hulme, C.5
Labaudiniere, R.F.6
-
111
-
-
0028411658
-
-
P. Gaillard, P. A. Carrupt, B. Testa and A. Boudon, J. Comput.-Aided Mol. Des., 1994, 8, 83.
-
(1994)
J. Comput.-aided Mol. Des.
, vol.8
, pp. 83
-
-
Gaillard, P.1
Carrupt, P.A.2
Testa, B.3
Boudon, A.4
-
113
-
-
0027930292
-
-
A. N. Jain, K. Koile and D. Chapman, J. Med. Chem., 1994, 37, 2315.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 2315
-
-
Jain, A.N.1
Koile, K.2
Chapman, D.3
-
114
-
-
0033552902
-
-
J. Mount, J. Ruppert, W. Welch and A. N. Jain, J. Med. Chem., 1999, 42, 60.
-
(1999)
J. Med. Chem.
, vol.42
, pp. 60
-
-
Mount, J.1
Ruppert, J.2
Welch, W.3
Jain, A.N.4
-
116
-
-
0033587166
-
-
A. M. Ghuloum, C. R. Sage and A. N. Jain, J. Med. Chem., 1999, 42, 1739.
-
(1999)
J. Med. Chem.
, vol.42
, pp. 1739
-
-
Ghuloum, A.M.1
Sage, C.R.2
Jain, A.N.3
-
118
-
-
0029240364
-
-
L. M. Kauvar, D. L. Higgins, H. O. Villar, J. R. Sportsman, A. Engqvist-Goldstein, R. Bukar, K. E. Bauer, H. Dilley and D. M. Rocke, Chem. Biol., 1995, 2, 107.
-
(1995)
Chem. Biol.
, vol.2
, pp. 107
-
-
Kauvar, L.M.1
Higgins, D.L.2
Villar, H.O.3
Sportsman, J.R.4
Engqvist-Goldstein, A.5
Bukar, R.6
Bauer, K.E.7
Dilley, H.8
Rocke, D.M.9
-
124
-
-
0000224701
-
-
J. H. Schuur, P. Selzer and J. Gasteiger, J. Chem. Inf. Comput. Sci., 1996, 36, 334.
-
(1996)
J. Chem. Inf. Comput. Sci.
, vol.36
, pp. 334
-
-
Schuur, J.H.1
Selzer, P.2
Gasteiger, J.3
-
125
-
-
0003102354
-
-
C. M. R. Ginn, D. B. Turner, P. Willett, A. M. Ferguson and T. W. Heritage, J. Chem. Inf. Comput. Sci., 1997, 37, 23.
-
(1997)
J. Chem. Inf. Comput. Sci.
, vol.37
, pp. 23
-
-
Ginn, C.M.R.1
Turner, D.B.2
Willett, P.3
Ferguson, A.M.4
Heritage, T.W.5
-
126
-
-
0035152857
-
-
V. Schoonjans, F. Questier, Q. Guo, Y. Van der Heyden and D. L. Massart, J. Pharm. Biomed. Anal., 2001, 24, 613.
-
(2001)
J. Pharm. Biomed. Anal.
, vol.24
, pp. 613
-
-
Schoonjans, V.1
Questier, F.2
Guo, Q.3
Van Der Heyden, Y.4
Massart, D.L.5
-
127
-
-
0001728108
-
-
A. Breindl, B. Beck, T. Clark and R. C. Glen, J. Mol. Model., 1997, 3, 142.
-
(1997)
J. Mol. Model.
, vol.3
, pp. 142
-
-
Breindl, A.1
Beck, B.2
Clark, T.3
Glen, R.C.4
-
129
-
-
0036386165
-
-
J. Meiler, W. Maier, M. Will and R. Meusinger, J. Magn. Reson., 2002, 157, 242.
-
(2002)
J. Magn. Reson.
, vol.157
, pp. 242
-
-
Meiler, J.1
Maier, W.2
Will, M.3
Meusinger, R.4
-
133
-
-
10344239156
-
-
W. B. Floriane, N. Vaidehi, G. Zamanakos and W. A. Goddard, 3rd, J. Med. Chem., 2004, 41, 56.
-
(2004)
J. Med. Chem.
, vol.41
, pp. 56
-
-
Floriane, W.B.1
Vaidehi, N.2
Zamanakos, G.3
Goddard III, W.A.4
-
134
-
-
0013060563
-
-
ed. B. Testa, H. van de Waterbeemd, G. Folkers and R. Guy, Wiley-VCH, Zurich
-
H. Kubinyi, in Hydrogen Bonding; The Last Mystery in Drug Design? ed. B. Testa, H. van de Waterbeemd, G. Folkers and R. Guy, Wiley-VCH, Zurich, 2001.
-
(2001)
Hydrogen Bonding; The Last Mystery in Drug Design?
-
-
Kubinyi, H.1
-
135
-
-
0003415098
-
-
Chapman & Hill, London
-
R. A. Hill, D.M. Kirk, H. L. J. Makin and G. M. Murphy, in Dictionary of Steroids, Chapman & Hill, London, 1991.
-
(1991)
Dictionary of Steroids
-
-
Hill, R.A.1
Kirk, D.M.2
Makin, H.L.J.3
Murphy, G.M.4
-
137
-
-
0033559918
-
-
A. M. Davis and S. J. Teague, Angew. Chem., Int. Edn. Engl., 1999, 38, 737.
-
(1999)
Angew. Chem., Int. Edn. Engl.
, vol.38
, pp. 737
-
-
Davis, A.M.1
Teague, S.J.2
-
138
-
-
0026093346
-
-
B. P. Morgan, J. M. Scholtz, M. D. Ballinger, I. D. Zipkin and P. A. Bartlett, J. Am. Chem. Soc., 1991, 113, 297.
-
(1991)
J. Am. Chem. Soc.
, vol.113
, pp. 297
-
-
Morgan, B.P.1
Scholtz, J.M.2
Ballinger, M.D.3
Zipkin, I.D.4
Bartlett, P.A.5
-
140
-
-
0028854034
-
-
G. Jones, P. Willett and R. C. Glen, J. Mol. Biol., 1995, 245, 43.
-
(1995)
J. Mol. Biol.
, vol.245
, pp. 43
-
-
Jones, G.1
Willett, P.2
Glen, R.C.3
-
142
-
-
0026292147
-
-
G. E. Kellogg, S. F. Semus and D. J. Abraham, J. Comput.-Aided Mol. Des., 1991, 5, 545.
-
(1991)
J. Comput.-aided Mol. Des.
, vol.5
, pp. 545
-
-
Kellogg, G.E.1
Semus, S.F.2
Abraham, D.J.3
-
145
-
-
0004169633
-
-
ed. D. B. Boyd and K. B. Lipkowitz, Wiley, New York
-
P. A. Carrupt, B. Testa and P. Gaillard, in Review in Computational Chemistry, ed. D. B. Boyd and K. B. Lipkowitz, Wiley, New York, 1997.
-
(1997)
Review in Computational Chemistry
-
-
Carrupt, P.A.1
Testa, B.2
Gaillard, P.3
-
146
-
-
0030474049
-
-
H.-J. Bohm and G. Klebe, Angew. Chem., Int. Edn. Engl., 1996, 35, 2588.
-
(1996)
Angew. Chem., Int. Edn. Engl.
, vol.35
, pp. 2588
-
-
Bohm, H.-J.1
Klebe, G.2
-
148
-
-
0029000922
-
-
A. R. Ortiz, M. T. Pisabarro, F. Gago and R. C. Wade, J. Med. Chem., 1995, 38, 2681.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 2681
-
-
Ortiz, A.R.1
Pisabarro, M.T.2
Gago, F.3
Wade, R.C.4
-
151
-
-
0035914380
-
-
M. Goel, D. Jain, K. J. Kaur, R. Kenoth, B. G. Maiya, M. J. Swamy and D. M. Salunke, J. Biol. Chem., 2001, 276, 39277.
-
(2001)
J. Biol. Chem.
, vol.276
, pp. 39277
-
-
Goel, M.1
Jain, D.2
Kaur, K.J.3
Kenoth, R.4
Maiya, B.G.5
Swamy, M.J.6
Salunke, D.M.7
-
152
-
-
0027141517
-
-
K. A. Brown, E. E. Howell and J. Kraut, Proc. Natl. Acad. Sci. USA, 1993, 90, 11753.
-
(1993)
Proc. Natl. Acad. Sci. USA
, vol.90
, pp. 11753
-
-
Brown, K.A.1
Howell, E.E.2
Kraut, J.3
-
154
-
-
0003675575
-
-
ed. O. F. Guner, International University Line, La Jolla
-
G. Jones, P. Willett and R. C. Glen, in Pharmacophore perception, development and use in drug design, ed. O. F. Guner, International University Line, La Jolla, 2000.
-
(2000)
Pharmacophore Perception, Development and Use in Drug Design
-
-
Jones, G.1
Willett, P.2
Glen, R.C.3
-
157
-
-
0037361983
-
-
D. M. Hawkins, S. C. Basak and D. Mills, J. Chem. Inf. Comput. Sci., 2003, 43, 579.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 579
-
-
Hawkins, D.M.1
Basak, S.C.2
Mills, D.3
-
158
-
-
0035350283
-
-
D. M. Hawkins, S. C. Basak and X. Shi, J. Chem. Inf. Comput. Sci., 2001, 41, 663.
-
(2001)
J. Chem. Inf. Comput. Sci.
, vol.41
, pp. 663
-
-
Hawkins, D.M.1
Basak, S.C.2
Shi, X.3
-
161
-
-
10344233423
-
-
Almond - Molecular Discovery Ltd. (http://www.mol-discovery.com).
-
-
-
-
162
-
-
0034632795
-
-
M. A. Kastenholz, M.Pastor, G. Cruciani, E. E. Haaksma and T. Fox, J. Med. Chem., 2000, 43, 3033.
-
(2000)
J. Med. Chem.
, vol.43
, pp. 3033
-
-
Kastenholz, M.A.1
Pastor, M.2
Cruciani, G.3
Haaksma, E.E.4
Fox, T.5
-
163
-
-
2442659094
-
-
F. Fontaine, M. Pastor and F. Sanz, J. Med. Chem., 2004, 47, 2805.
-
(2004)
J. Med. Chem.
, vol.47
, pp. 2805
-
-
Fontaine, F.1
Pastor, M.2
Sanz, F.3
-
164
-
-
0242438742
-
-
N. Stiefl, G. Bringmann, C. Rummey and K. Baumann, J. Comput.-Aided Mol. Des., 2003, 17, 347.
-
(2003)
J. Comput.-aided Mol. Des.
, vol.17
, pp. 347
-
-
Stiefl, N.1
Bringmann, G.2
Rummey, C.3
Baumann, K.4
-
165
-
-
0030040323
-
-
M. F. Sanner, A. J. Olson and J. C. Spehner, Biopolymers, 1996, 38, 305.
-
(1996)
Biopolymers
, vol.38
, pp. 305
-
-
Sanner, M.F.1
Olson, A.J.2
Spehner, J.C.3
-
167
-
-
0345735309
-
-
R. J. Zauhar, G. Moyna, L. Tian, Z. Li and W. J. Welsh, J. Med. Chem., 2003, 46, 5674.
-
(2003)
J. Med. Chem.
, vol.46
, pp. 5674
-
-
Zauhar, R.J.1
Moyna, G.2
Tian, L.3
Li, Z.4
Welsh, W.J.5
-
171
-
-
0346962971
-
-
Z. Deng, C. Chuaqui and J. Singh, J. Med. Chem., 2004, 47, 337.
-
(2004)
J. Med. Chem.
, vol.47
, pp. 337
-
-
Deng, Z.1
Chuaqui, C.2
Singh, J.3
-
172
-
-
0036708528
-
-
S. Putta, C. Lemmen, P. Beroza and J. Greene, J. Chem. Inf. Comput. Sci., 2002, 42, 1230.
-
(2002)
J. Chem. Inf. Comput. Sci.
, vol.42
, pp. 1230
-
-
Putta, S.1
Lemmen, C.2
Beroza, P.3
Greene, J.4
-
173
-
-
1842754137
-
-
HQSAR Module, Tripos Inc., St. Louis, Minnesota, USA
-
SYBYL, Version 6.5.3, HQSAR Module, Tripos Inc., St. Louis, Minnesota, USA.
-
SYBYL, Version 6.5.3
-
-
-
174
-
-
0141925236
-
-
S. Putta, J. Eksterowicz, C. Lemmen and R. Stanton, J. Chem. Inf. Comput. Sci., 2003, 43, 1623.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 1623
-
-
Putta, S.1
Eksterowicz, J.2
Lemmen, C.3
Stanton, R.4
-
177
-
-
0032604147
-
-
World Scientific Press, Hackensack, NJ, USA
-
J. S. Mason and D. L. Cheney, Pac. Symp. Biocomput., World Scientific Press, Hackensack, NJ, USA, 1999, p. 456.
-
(1999)
Pac. Symp. Biocomput.
, pp. 456
-
-
Mason, J.S.1
Cheney, D.L.2
-
178
-
-
0000339851
-
-
World Scientific Press, Hackensack, NJ, USA, p
-
J. S. Mason and D. L. Cheney, Pac. Symp. Biocomput., 2000, World Scientific Press, Hackensack, NJ, USA, p. 573.
-
(2000)
Pac. Symp. Biocomput.
, pp. 573
-
-
Mason, J.S.1
Cheney, D.L.2
-
179
-
-
0037365122
-
-
N. Rhodes, P. Willett, A. Calvet, J. B. Dunbar and C. Humblet, J. Chem. Inf. Comput. Sci., 2003, 43, 443.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 443
-
-
Rhodes, N.1
Willett, P.2
Calvet, A.3
Dunbar, J.B.4
Humblet, C.5
-
180
-
-
0030700312
-
-
A. J. Hopfinger, S. Wang, J. S. Tokarski, B. Q. Jin, M. Albuquerque, P. J. Madhav and C. Duraiswami, J. Am. Chem. Soc., 1997, 119, 10509.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 10509
-
-
Hopfinger, A.J.1
Wang, S.2
Tokarski, J.S.3
Jin, B.Q.4
Albuquerque, M.5
Madhav, P.J.6
Duraiswami, C.7
-
181
-
-
0001609280
-
-
A. J. Hopfinger, A. Reaka, P. Venkatarangan, J. S. Duca and S. Wang, J. Chem. Inf. Comput. Sci., 1999, 39, 1151.
-
(1999)
J. Chem. Inf. Comput. Sci.
, vol.39
, pp. 1151
-
-
Hopfinger, A.J.1
Reaka, A.2
Venkatarangan, P.3
Duca, J.S.4
Wang, S.5
-
182
-
-
0344254799
-
-
J. Liu, D. Pan, Y. Tseng and A. J. Hopfiniger, J. Chem. Inf. Comput. Sci., 2003, 43, 2170.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 2170
-
-
Liu, J.1
Pan, D.2
Tseng, Y.3
Hopfiniger, A.J.4
-
183
-
-
0032849040
-
-
S. Ekins, G. Bravi, S. Binkley, J. S. Gillespie, B. J. Ring, J. H. Wikel and S. A. Wrighton, Pharmacogenetics, 1999, 9, 477.
-
(1999)
Pharmacogenetics
, vol.9
, pp. 477
-
-
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
-
184
-
-
0037130185
-
-
M. D. Krasowski, X. Hong, A. J. Hopfinger and N. L. Harrison, J. Med. Chem., 2002, 45, 3210.
-
(2002)
J. Med. Chem.
, vol.45
, pp. 3210
-
-
Krasowski, M.D.1
Hong, X.2
Hopfinger, A.J.3
Harrison, N.L.4
-
187
-
-
0034676316
-
-
A. Vedani, H. Briem, M. Dobler, H. Dollinger and D. R. McMasters, J. Med. Chem., 2000, 43, 4416.
-
(2000)
J. Med. Chem.
, vol.43
, pp. 4416
-
-
Vedani, A.1
Briem, H.2
Dobler, M.3
Dollinger, H.4
McMasters, D.R.5
-
189
-
-
0037362042
-
-
M. Whittle, P. Willett, W. Klaffke and P. van Noort, J. Chem. Inf. Comput. Sci., 2003, 43, 449.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 449
-
-
Whittle, M.1
Willett, P.2
Klaffke, W.3
Van Noort, P.4
-
190
-
-
0037361941
-
-
N. Salim, J. Holliday and P. Willett, J. Chem. Inf. Comput. Sci., 2003, 43, 435.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 435
-
-
Salim, N.1
Holliday, J.2
Willett, P.3
-
191
-
-
0001535816
-
-
J. W. Godden, L. Xue and J. Bajorath, J. Chem. Inf. Comput. Sci., 2000, 40, 163.
-
(2000)
J. Chem. Inf. Comput. Sci.
, vol.40
, pp. 163
-
-
Godden, J.W.1
Xue, L.2
Bajorath, J.3
-
192
-
-
0037835585
-
-
J. D. Holliday, N. Salim, M. Whittle and P. Willett, J. Chem. Inf. Comput. Sci., 2003, 43, 819.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 819
-
-
Holliday, J.D.1
Salim, N.2
Whittle, M.3
Willett, P.4
-
193
-
-
0036567220
-
-
M. A. Fligner, J. S. Verducci and P. E. Blower, Technometrics, 2002, 44, 110.
-
(2002)
Technometrics
, vol.44
, pp. 110
-
-
Fligner, M.A.1
Verducci, J.S.2
Blower, P.E.3
-
195
-
-
2942721004
-
-
M. L. Verdonk, V. Berdini, M. J. Hartshorn, W. T. M. Mooij, C. W. Murray, R. D. Taylor and P. Watson, J. Chem. Inf. Comput. Sci., 2004, 44, 793.
-
(2004)
J. Chem. Inf. Comput. Sci.
, vol.44
, pp. 793
-
-
Verdonk, M.L.1
Berdini, V.2
Hartshorn, M.J.3
Mooij, W.T.M.4
Murray, C.W.5
Taylor, R.D.6
Watson, P.7
-
196
-
-
0033669056
-
-
C. M. R. Ginn, P. Willett and J. Bradshaw, Perspect. Drug Discovery Design, 2000, 20, 1.
-
(2000)
Perspect. Drug Discovery Design
, vol.20
, pp. 1
-
-
Ginn, C.M.R.1
Willett, P.2
Bradshaw, J.3
-
197
-
-
0033576680
-
-
P. S. Charifson, J. J. Corkery, M. A. Murcko and W. P. Walters, J. Med. Chem., 1999, 42, 5100.
-
(1999)
J. Med. Chem.
, vol.42
, pp. 5100
-
-
Charifson, P.S.1
Corkery, J.J.2
Murcko, M.A.3
Walters, W.P.4
-
199
-
-
0026459988
-
-
R. D. King, S. Muggleton, R. A. Lewis and M. J. Sternberg, Proc. Natl. Acad. Sci. USA, 1992, 89, 11322.
-
(1992)
Proc. Natl. Acad. Sci. USA
, vol.89
, pp. 11322
-
-
King, R.D.1
Muggleton, S.2
Lewis, R.A.3
Sternberg, M.J.4
-
204
-
-
0034740222
-
-
R. Burbidge, M. Trotter, B. Buxton and S. Holden, Comput. Chem., 2001, 26, 5.
-
(2001)
Comput. Chem.
, vol.26
, pp. 5
-
-
Burbidge, R.1
Trotter, M.2
Buxton, B.3
Holden, S.4
-
205
-
-
0344254815
-
-
V. V. Zernov, K. V. Balakin, A. A. Ivaschenko, N. P. Savchuk and I. V. Pletnev, J. Chem. Inf. Comput. Sci., 2003, 43, 2048.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 2048
-
-
Zernov, V.V.1
Balakin, K.V.2
Ivaschenko, A.A.3
Savchuk, N.P.4
Pletnev, I.V.5
-
207
-
-
0037365194
-
-
M. K. Warmuth, J. Liao, G. Ratsch, M. Mathieson, S. Putta and C. Lemmen, J. Chem. Inf. Comput. Sci., 2003, 43, 667.
-
(2003)
J. Chem. Inf. Comput. Sci.
, vol.43
, pp. 667
-
-
Warmuth, M.K.1
Liao, J.2
Ratsch, G.3
Mathieson, M.4
Putta, S.5
Lemmen, C.6
-
208
-
-
0242417619
-
-
J. Weston, F. Perez-Cruz, O. Bousquet, O. Chapelle, A. Elisseeff and B. Scholkopf, Bioinformatics, 2003, 19, 764.
-
(2003)
Bioinformatics
, vol.19
, pp. 764
-
-
Weston, J.1
Perez-Cruz, F.2
Bousquet, O.3
Chapelle, O.4
Elisseeff, A.5
Scholkopf, B.6
-
209
-
-
0036490889
-
-
I. Doytchinova, I. Valkova and R. Natcheva, SAR QSAR Environ. Res., 2002, 13, 227.
-
(2002)
SAR QSAR Environ. Res.
, vol.13
, pp. 227
-
-
Doytchinova, I.1
Valkova, I.2
Natcheva, R.3
-
210
-
-
0035848568
-
-
H. Lanig, W. Utz and P. Gmeiner, J. Med. Chem., 2001, 44, 1151.
-
(2001)
J. Med. Chem.
, vol.44
, pp. 1151
-
-
Lanig, H.1
Utz, W.2
Gmeiner, P.3
-
211
-
-
0027522683
-
-
A. D. Harpalani, S. W. Snyder, B. Subramanyam, M. J. Egorin and P. S. Gallery, Cancer Res., 1993, 53, 766.
-
(1993)
Cancer Res.
, vol.53
, pp. 766
-
-
Harpalani, A.D.1
Snyder, S.W.2
Subramanyam, B.3
Egorin, M.J.4
Gallery, P.S.5
-
212
-
-
0034131292
-
-
R. Ragno, G. R. Marshall, R. Di Santo, R. Costi, S. Massa, R. Rompei and M. Artico, Bioorg. Med. Chem., 2000, 8, 1423.
-
(2000)
Bioorg. Med. Chem.
, vol.8
, pp. 1423
-
-
Ragno, R.1
Marshall, G.R.2
Di Santo, R.3
Costi, R.4
Massa, S.5
Rompei, R.6
Artico, M.7
-
213
-
-
0035821592
-
-
X. Q. Huang, T. Liu, J. D. Gu, X. M. Luo, R. Y. Ji, Y. Cao, H. Xue, J. T. F. Wong, B. L. Wong, G. Pei, H. L. Jiang and K. X. Chen, J. Med. Chem., 2001, 44, 1883.
-
(2001)
J. Med. Chem.
, vol.44
, pp. 1883
-
-
Huang, X.Q.1
Liu, T.2
Gu, J.D.3
Luo, X.M.4
Ji, R.Y.5
Cao, Y.6
Xue, H.7
Wong, J.T.F.8
Wong, B.L.9
Pei, G.10
Jiang, H.L.11
Chen, K.X.12
-
214
-
-
0027135414
-
-
J. P. Horwitz, I. Massova, T. E. Wiese, A. J. Wozniak, T. H. Corbett, J. S. Sebolt-Leopold, D. B. Capps and W. R. Leopold, J. Med. Chem., 1993, 36, 3511.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 3511
-
-
Horwitz, J.P.1
Massova, I.2
Wiese, T.E.3
Wozniak, A.J.4
Corbett, T.H.5
Sebolt-Leopold, J.S.6
Capps, D.B.7
Leopold, W.R.8
-
215
-
-
0036491665
-
-
S. Timofei, L. Kurunczi, W. Schmidt and Z. Simon, SAR QSAR Environ. Res., 2002, 13, 219.
-
(2002)
SAR QSAR Environ. Res.
, vol.13
, pp. 219
-
-
Timofei, S.1
Kurunczi, L.2
Schmidt, W.3
Simon, Z.4
|