-
1
-
-
0028297112
-
Application of three-dimensional structures of protein target molecules in structure-based drug design
-
Greer. J.: Erickson. J. W.; Baldwin. J. J.: Varneyk, M. D. Application of three-dimensional structures of protein target molecules in structure-based drug design. J. Med. Chem. 1994, 37, 1035-1054.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1035-1054
-
-
Greer, J.1
Erickson, J.W.2
Baldwin, J.J.3
Varneyk, M.D.4
-
2
-
-
0025989570
-
NMR studies of molecular complexes as a tool in drug design
-
Fesik. S. W. NMR studies of molecular complexes as a tool in drug design. J. Med. Chem. 1991, 34, 2937-2945.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 2937-2945
-
-
Fesik, S.W.1
-
3
-
-
0025881062
-
Three-dimensional models of neurotransmitter G-binding protein-coupled receptors
-
Hibert, M. F.; Trumpp-Kallmeyer. S.; Bruinvels. A.; Hoflack, J. Three-dimensional models of neurotransmitter G-binding protein-coupled receptors. Mol. Pharmacol. 1991, 40, 8-15.
-
(1991)
Mol. Pharmacol.
, vol.40
, pp. 8-15
-
-
Hibert, M.F.1
Trumpp-Kallmeyer, S.2
Bruinvels, A.3
Hoflack, J.4
-
4
-
-
0026660322
-
Modeling of G-protein-coupled receptors: Application to dopamine, adrenaline, serotonin, acetylcholine, and mammalian opsin receptors
-
Trumpp-Kallmeyer, S.; Hoflack, J.; Bruinvels, A.; Hibert, M. Modeling of G-protein-coupled receptors: Application to dopamine, adrenaline, serotonin, acetylcholine, and mammalian opsin receptors. J. Med. Chem. 1992, 35, 3448-3462.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 3448-3462
-
-
Trumpp-Kallmeyer, S.1
Hoflack, J.2
Bruinvels, A.3
Hibert, M.4
-
5
-
-
0011219025
-
Three-dimensional models of G-protein coupled receptors
-
Humblet, C.; Mirzadegan, T. Three-dimensional models of G-protein coupled receptors. Annu. Rep. Med. Chem. 1992, 27, 291-300.
-
(1992)
Annu. Rep. Med. Chem.
, vol.27
, pp. 291-300
-
-
Humblet, C.1
Mirzadegan, T.2
-
6
-
-
0000460468
-
The conformational parameter in drug design: The Active Analog Approach
-
Olson, E. C., Christofersen, R. E., Eds.; American Chemical Society: Washington
-
Marshall, G. R.; Barry, C. D.; Bosshard, H. E., Dammkoehler, R. A.; Dunn. D. A. The conformational parameter in drug design: The Active Analog Approach. In Computer-Assisted Drug Design, American Chemical Society Symposium: Olson, E. C., Christofersen, R. E., Eds.; American Chemical Society: Washington, 1979; Vol. 112, pp 205-226.
-
(1979)
Computer-Assisted Drug Design, American Chemical Society Symposium
, vol.112
, pp. 205-226
-
-
Marshall, G.R.1
Barry, C.D.2
Bosshard, H.E.3
Dammkoehler, R.A.4
Dunn, D.A.5
-
7
-
-
0027413349
-
Pseudo-receptor modeling: A new concept for the three-dimensional construction of receptor binding sites
-
Vedani, A.; Zbinden, P.; Snyder, J. P. Pseudo-receptor modeling: A new concept for the three-dimensional construction of receptor binding sites. J. Rec. Res. 1993, 13, 163-177.
-
(1993)
J. Rec. Res.
, vol.13
, pp. 163-177
-
-
Vedani, A.1
Zbinden, P.2
Snyder, J.P.3
-
8
-
-
0002795262
-
Minireceptors and pseudoreceptors
-
Kubinyi, H., Ed.; Escom Science Publishers B.V.: Leiden. The Netherlands
-
Snyder, J. P.; Rao, S. N.; Koehler, K. F.; Vedani, A. Minireceptors and pseudoreceptors. In 3D QSAR in drug design; Kubinyi, H., Ed.; Escom Science Publishers B.V.: Leiden. The Netherlands 1993; pp 336-354.
-
(1993)
3D QSAR in Drug Design
, pp. 336-354
-
-
Snyder, J.P.1
Rao, S.N.2
Koehler, K.F.3
Vedani, A.4
-
9
-
-
0029135744
-
Pseudoreceptor modeling: The construction of three-dimensional receptor surrogates
-
Vedani, A.; Zbinden, P.; Snyder, J. P.; Greenidge, P. A. Pseudoreceptor modeling: The construction of three-dimensional receptor surrogates. J. Am. Chem. Soc. 1995, 117, 4987-4994.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 4987-4994
-
-
Vedani, A.1
Zbinden, P.2
Snyder, J.P.3
Greenidge, P.A.4
-
10
-
-
0028493139
-
Current methods for site-directed structure generation
-
Lewis, R. A.; Leach, A. R. Current methods for site-directed structure generation. J. Comp.-Aided Mol. Design 1994, 8, 467-475.
-
(1994)
J. Comp.-Aided Mol. Design
, vol.8
, pp. 467-475
-
-
Lewis, R.A.1
Leach, A.R.2
-
11
-
-
0028081385
-
PRO LIGAND: An approach to de novo molecular design. 2. Design of novel molecules from molecular field analysis (MFA) models and pharmacophores
-
Waszkowycz, B.; Clark, D. E.; Frenkel, D.; Li, J.; Murray, C. W.; Robson, B.; Westhead, D. R. PRO LIGAND: An approach to de novo molecular design. 2. Design of novel molecules from molecular field analysis (MFA) models and pharmacophores. J. Med. Chem. 1994, 37, 3994-4002.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 3994-4002
-
-
Waszkowycz, B.1
Clark, D.E.2
Frenkel, D.3
Li, J.4
Murray, C.W.5
Robson, B.6
Westhead, D.R.7
-
12
-
-
0026642983
-
3D Database searching in drug design
-
Martin, Y. C. 3D Database searching in drug design. J. Med. Chem. 1992, 35, 2145-2154.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 2145-2154
-
-
Martin, Y.C.1
-
13
-
-
77956822846
-
3D Database searching and docking strategies
-
Humblet, C.; Dunbar, J. B. 3D Database searching and docking strategies. Annu. Rep. Med. Chem. 1993, 28, 275-284.
-
(1993)
Annu. Rep. Med. Chem.
, vol.28
, pp. 275-284
-
-
Humblet, C.1
Dunbar, J.B.2
-
14
-
-
85050324014
-
Searching techniques for databases of three-dimensional chemical structures
-
Bures, M. G.; Martin, Y. C.; Willen, P. Searching techniques for databases of three-dimensional chemical structures. Topics Stereo-chemistry 1994, 21, 467-511.
-
(1994)
Topics Stereo-chemistry
, vol.21
, pp. 467-511
-
-
Bures, M.G.1
Martin, Y.C.2
Willen, P.3
-
15
-
-
0030201178
-
The high affinity melatonin binding site probed with conformationally restricted ligands I: Pharmacophore and minireceptor models
-
Jansen, J. M.; Copinga, S.: Gruppen, G.; Molinari, E. J.; Dubocovich, M. L.; Grol, C. J. The high affinity melatonin binding site probed with conformationally restricted ligands I: Pharmacophore and minireceptor models. Bioorg. Med. Chem. 1996, 4, 1321-1332.
-
(1996)
Bioorg. Med. Chem.
, vol.4
, pp. 1321-1332
-
-
Jansen, J.M.1
Copinga, S.2
Gruppen, G.3
Molinari, E.J.4
Dubocovich, M.L.5
Grol, C.J.6
-
16
-
-
85033158856
-
-
SIAT Biographies Laboratory, Missionsstrasse 60, CH-4055 Basel, Switzerland
-
SIAT Biographies Laboratory, Missionsstrasse 60, CH-4055 Basel, Switzerland.
-
-
-
-
17
-
-
0025158237
-
A new force field for modeling metalloproteins
-
Vedani, A.; Huhta, D. W. A new force field for modeling metalloproteins. J. Am. Chem. Soc. 1990, 112, 4759-4767.
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 4759-4767
-
-
Vedani, A.1
Huhta, D.W.2
-
18
-
-
0015211527
-
Plant antitumor agents. VI. The isolation and structure of taxol, a novel antileukemic and antitumor agent from Taxus brevifolia
-
Wani, M. C.; Taylor, H. L.; Wall, M. E.; Coggon, P.; McPhail, A. T. Plant antitumor agents. VI. The isolation and structure of taxol, a novel antileukemic and antitumor agent from Taxus brevifolia, J. Am. Chem. Soc. 1971, 93, 2325-2327.
-
(1971)
J. Am. Chem. Soc.
, vol.93
, pp. 2325-2327
-
-
Wani, M.C.1
Taylor, H.L.2
Wall, M.E.3
Coggon, P.4
McPhail, A.T.5
-
19
-
-
0026344562
-
The chemistry of taxol
-
Kingston, D. G. I. The chemistry of taxol. Pharmac. Ther. 1992, 52, 1-34.
-
(1992)
Pharmac. Ther.
, vol.52
, pp. 1-34
-
-
Kingston, D.G.I.1
-
20
-
-
0000052734
-
Taxol and Taxotere: Discovery, Chemistry, and Structure-Activity Relationships
-
Guénard, D.; Guéritte-Voegelein, F.; Potier, P. Taxol and Taxotere: Discovery, Chemistry, and Structure-Activity Relationships. Acc. Chem. Res. 1993, 26, 160-167.
-
(1993)
Acc. Chem. Res.
, vol.26
, pp. 160-167
-
-
Guénard, D.1
Guéritte-Voegelein, F.2
Potier, P.3
-
21
-
-
77956791953
-
Taxol: From discovery to therapeutic use
-
Suffness, M. Taxol: From discovery to therapeutic use. Annu. Rep. Med. Chem. 1993, 28, 305-314.
-
(1993)
Annu. Rep. Med. Chem.
, vol.28
, pp. 305-314
-
-
Suffness, M.1
-
22
-
-
0028452906
-
Taxol: The chemistry and Structure-Activity Relationships of a novel anticancer agent
-
Kingston, D. G. I. Taxol: The chemistry and Structure-Activity Relationships of a novel anticancer agent. Trends Biotech. 1994, 12, 222-227.
-
(1994)
Trends Biotech.
, vol.12
, pp. 222-227
-
-
Kingston, D.G.I.1
-
23
-
-
0018387446
-
Promotion of microtubule assembly in vitro by taxol
-
Schiff, P. B.; Fant, J.; Horwitz, S. B. Promotion of microtubule assembly in vitro by taxol. Nature 1979, 277, 665-667.
-
(1979)
Nature
, vol.277
, pp. 665-667
-
-
Schiff, P.B.1
Fant, J.2
Horwitz, S.B.3
-
24
-
-
0000297058
-
Taxol stabilizes microtubules in mouse fibroblast cells
-
Schiff, P. B.; Horwitz, S. B. Taxol stabilizes microtubules in mouse fibroblast cells. Proc. Natl. Acad. Sci. U.S.A. 1980, 77, 1561-1565.
-
(1980)
Proc. Natl. Acad. Sci. U.S.A.
, vol.77
, pp. 1561-1565
-
-
Schiff, P.B.1
Horwitz, S.B.2
-
25
-
-
0026516994
-
Mechanism of action of taxol
-
Horwitz, S. B. Mechanism of action of taxol. Trends Pharm. Sci. 1992, 13, 134-136.
-
(1992)
Trends Pharm. Sci.
, vol.13
, pp. 134-136
-
-
Horwitz, S.B.1
-
26
-
-
0028200190
-
Characterization of two taxol photoaffinity analogues bearing azide and benzophenone-related photoreactive substituents in the A-ring side chain
-
Swindell, C. S.; Heerding, J. M.; Krauss, N. E.; Horwitz, S. B;. Rao, S.; Ringel, I. Characterization of two taxol photoaffinity analogues bearing azide and benzophenone-related photoreactive substituents in the A-ring side chain. J. Med. Chem. 1994, 37, 1446-1449.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 1446-1449
-
-
Swindell, C.S.1
Heerding, J.M.2
Krauss, N.E.3
Horwitz, S.B.4
Rao, S.5
Ringel, I.6
-
27
-
-
0028169689
-
3′-(p-Azidobenzamido)taxol photolabels the N-terminal 31 amino acids of β-tubulin
-
Rao, S.; Krauss, N. E.; Heerding, J. M.; Swindell, C. S.; Ringel, I.; Orr, G. A.; Horwitz, S. B. 3′-(p-Azidobenzamido)taxol photolabels the N-terminal 31 amino acids of β-tubulin. J. Biol. Chem. 1994, 269, 3132-3134.
-
(1994)
J. Biol. Chem.
, vol.269
, pp. 3132-3134
-
-
Rao, S.1
Krauss, N.E.2
Heerding, J.M.3
Swindell, C.S.4
Ringel, I.5
Orr, G.A.6
Horwitz, S.B.7
-
28
-
-
0028123221
-
Synthesis of a photoaffinity taxol analogue and its use in labeling tubulin
-
Dasgupta, D.; Park, H.; Harriman, G. C. B.; Georg, G. I.; Himes, R. H. Synthesis of a photoaffinity taxol analogue and its use in labeling tubulin. J. Med. Chem. 1994, 37, 2976-2980.
-
(1994)
J. Med. Chem.
, vol.37
, pp. 2976-2980
-
-
Dasgupta, D.1
Park, H.2
Harriman, G.C.B.3
Georg, G.I.4
Himes, R.H.5
-
29
-
-
0027213794
-
Conformation of taxotere and analogues determined by NMR spectroscopy and molecular modeling studies
-
Dubois, J.; Guénard, D.; Gueritte-Voegelein, F.; Guedira, N.; Potier, P.; Gillet, B.; Beloeil, J.-C. Conformation of taxotere and analogues determined by NMR spectroscopy and molecular modeling studies. Tetrahedron 1993, 49, 6533-6544.
-
(1993)
Tetrahedron
, vol.49
, pp. 6533-6544
-
-
Dubois, J.1
Guénard, D.2
Gueritte-Voegelein, F.3
Guedira, N.4
Potier, P.5
Gillet, B.6
Beloeil, J.-C.7
-
30
-
-
0027305373
-
NMR and molecular modeling study of the conformations of taxol and of its side chain methylester in aqueous and non-aqueous solution
-
Williams, H. J.; Scott, A. I.; Dieden, R. A.; Swindell, C. S.; Chirlian, L. E.; Francl, M. M.; Heerding, J. M.; Krauss, N. E. NMR and molecular modeling study of the conformations of taxol and of its side chain methylester in aqueous and non-aqueous solution. Tetrahedron 1993, 49, 6545-6560.
-
(1993)
Tetrahedron
, vol.49
, pp. 6545-6560
-
-
Williams, H.J.1
Scott, A.I.2
Dieden, R.A.3
Swindell, C.S.4
Chirlian, L.E.5
Francl, M.M.6
Heerding, J.M.7
Krauss, N.E.8
-
31
-
-
0028347919
-
NMR and molecular modeling study of active and inactive taxol analogues in aqueous and nonaqueous solution
-
Williams, H. J.; Scott, A. I.; Dieden, R. A.; Swindell, C. S.; Chirlian, L. E.; Francl, M. M.; Heerding, J. M.; Krauss, N. E. NMR and molecular modeling study of active and inactive taxol analogues in aqueous and nonaqueous solution. Can. J. Chem. 1994, 72, 252-260.
-
(1994)
Can. J. Chem.
, vol.72
, pp. 252-260
-
-
Williams, H.J.1
Scott, A.I.2
Dieden, R.A.3
Swindell, C.S.4
Chirlian, L.E.5
Francl, M.M.6
Heerding, J.M.7
Krauss, N.E.8
-
32
-
-
0026663359
-
G-protein linked receptors: A family probed by molecular cloning and mutagenesis procedures
-
Houslay, M. D. G-protein linked receptors: A family probed by molecular cloning and mutagenesis procedures. Clin. Endocrinol. 1992, 36, 525-534.
-
(1992)
Clin. Endocrinol.
, vol.36
, pp. 525-534
-
-
Houslay, M.D.1
-
33
-
-
0026548156
-
In vitro mutagenesis and the search for structure-function relationships among G protein-coupled receptors
-
Savarese, T. M.; Fraser, C. M. In vitro mutagenesis and the search for structure-function relationships among G protein-coupled receptors. Biochem. J. 1992, 283, 1-19.
-
(1992)
Biochem. J.
, vol.283
, pp. 1-19
-
-
Savarese, T.M.1
Fraser, C.M.2
-
34
-
-
0025292355
-
Model for the structure of bacteriorhodopsin based on high-resolution electron cryo-microscopy
-
Henderson, R.; Baldwin, J. M.; Ceska, T. A.; Zemlin, F.; Beckmann, E.; Downing, K.H. Model for the structure of bacteriorhodopsin based on high-resolution electron cryo-microscopy. J. Mol. Biol 1990, 213, 899-929.
-
(1990)
J. Mol. Biol
, vol.213
, pp. 899-929
-
-
Henderson, R.1
Baldwin, J.M.2
Ceska, T.A.3
Zemlin, F.4
Beckmann, E.5
Downing, K.H.6
-
35
-
-
0027278101
-
Binding-site modeling of the muscarinic m1 receptor: A combination of homology based and indirect approaches
-
Nordvall, G.; Hacksell, U. Binding-site modeling of the muscarinic m1 receptor: A combination of homology based and indirect approaches. J. Med. Chem. 1993, 36, 967-976.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 967-976
-
-
Nordvall, G.1
Hacksell, U.2
-
37
-
-
0028121033
-
Neuropharmacology of anxiety: Perspectives and prospects
-
Hamon, M. Neuropharmacology of anxiety: Perspectives and prospects. Trends Pharmacol. Sci. 1994, 15. 36-39.
-
(1994)
Trends Pharmacol. Sci.
, vol.15
, pp. 36-39
-
-
Hamon, M.1
-
38
-
-
0027193582
-
5-HT-1A receptor-mediated effects of antidepressants
-
Newman, M. E.; Lerer, B.; Shapira, B. 5-HT-1A receptor-mediated effects of antidepressants. Prog. Neuropsychopharmacol. Biol. Psychiat. 1993, 17, 1-19.
-
(1993)
Prog. Neuropsychopharmacol. Biol. Psychiat.
, vol.17
, pp. 1-19
-
-
Newman, M.E.1
Lerer, B.2
Shapira, B.3
-
39
-
-
0029017726
-
1A receptor interactions
-
1A receptor interactions. J. Med. Chem. 1995, 38, 647-658.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 647-658
-
-
Hedberg, M.H.1
Johansson, A.M.2
Nordvall, G.3
Yliniemelä, A.4
Li, H.-B.5
Martin, A.R.6
Hjorth, S.7
Unelius, L.8
Sundell, S.9
Hacksell, U.10
-
40
-
-
0029795725
-
1A receptor interactions
-
1A receptor interactions. J. Med. Chem. 1996, 39, 3491-3502.
-
(1996)
J. Med. Chem.
, vol.39
, pp. 3491-3502
-
-
Hedberg, M.H.1
Jansen, J.M.2
Nordvall, G.3
Hjorth, S.4
Unelius, L.5
Johansson, A.M.6
-
41
-
-
0029795607
-
1A receptor interactions
-
1A receptor interactions. J. Med. Chem. 1996, 39, 3503-3513.
-
(1996)
J. Med. Chem.
, vol.39
, pp. 3503-3513
-
-
Hedberg, M.H.1
Linnanen, T.2
Jansen, J.M.3
Nordvall, G.4
Hjorth, S.5
Unelius, L.6
Johansson, A.M.7
-
42
-
-
0029120320
-
MD simulations in pseudo-particle fluids: Applications to active-site protein complexes
-
Kern, P.; Rognan, D.; Folkers, G. MD simulations in pseudo-particle fluids: Applications to active-site protein complexes. Quant Struct.-Act. Relat. 1995, 14, 229-241.
-
(1995)
Quant Struct.-Act. Relat.
, vol.14
, pp. 229-241
-
-
Kern, P.1
Rognan, D.2
Folkers, G.3
-
43
-
-
0030152490
-
A pseudoparticle approach for studying protein-ligand models truncated to their active sites
-
Kern, P.; Brunne, R. M.; van Gunsteren, W. G.; Folkers, G. A pseudoparticle approach for studying protein-ligand models truncated to their active sites. Biopolymers 1996, 38, 619-637.
-
(1996)
Biopolymers
, vol.38
, pp. 619-637
-
-
Kern, P.1
Brunne, R.M.2
Van Gunsteren, W.G.3
Folkers, G.4
|