-
1
-
-
0024507731
-
Molecular biology of 5-HT receptors
-
Hatrig, P. R. Molecular biology of 5-HT receptors. Trends Pharmacol. Sci. 1989, 10, 64-69.
-
(1989)
Trends Pharmacol. Sci.
, vol.10
, pp. 64-69
-
-
Hatrig, P.R.1
-
5
-
-
0028125102
-
2A receptor selectivity of simple 1-(2-pyrimidinyl)piperazine derivatives
-
2A Receptor Selectivity of Simple 1-(2-pyrimidinyl)piperazine Derivatives. Pharmazie 1994, 49, 801-806.
-
(1994)
Pharmazie
, vol.49
, pp. 801-806
-
-
Mokrosz, J.L.1
Strekowski, L.2
Duszyńska, B.3
Harden, D.B.4
Mokrosz, M.J.5
Bojarski, A.J.6
-
7
-
-
0031434910
-
Three-dimensional quantitative structure-activity relationships from molecular similarity matrices and genetic neural networks. 1. Method and validations
-
So, S.-S.; Karplus, M. Three-dimensional quantitative structure-activity relationships from molecular similarity matrices and genetic neural networks. 1. Method and validations. J. Med. Chem. 1997, 40, 4347-4359.
-
(1997)
J. Med. Chem.
, vol.40
, pp. 4347-4359
-
-
So, S.-S.1
Karplus, M.2
-
8
-
-
0031466773
-
Three-dimensional quantitative structure-activity relationships from molecular similarity matrices and genetic neural networks. 2. Applications
-
So, S.-S.; Karplus, M. Three-dimensional quantitative structure-activity relationships from molecular similarity matrices and genetic neural networks. 2. Applications. J. Med. Chem. 1997, 40, 4360-4371.
-
(1997)
J. Med. Chem.
, vol.40
, pp. 4360-4371
-
-
So, S.-S.1
Karplus, M.2
-
9
-
-
0028839408
-
2A receptor ligands: A verification of the topographic model
-
2A Receptor Ligands: A Verification of the Topographic Model. Arch. Pharm. 1995, 328, 659-666.
-
(1995)
Arch. Pharm.
, vol.328
, pp. 659-666
-
-
Mokrosz, M.J.1
Strekowski, L.2
Kozak, W.X.3
Duszyńska, B.4
Bojarski, A.J.5
Kłdzinska, A.6
Czarny, A.7
Cegła, M.T.8
Dereń-Wesołek, A.9
Chojnacka-Wójcik, E.10
Dove, S.11
Mokrosz, J.L.12
-
10
-
-
0030076120
-
Determination of receptor-bound drug conformations by QSAR using flexibile fitting to derive a molecular similarity index
-
Montanari, C. A.; Tute, M. S.; Beezer, A. E.; Mitchell, J. C. Determination of receptor-bound drug conformations by QSAR using flexibile fitting to derive a molecular similarity index. J. Comput.-Aided Mol. Des. 1996, 10, 67-73.
-
(1996)
J. Comput.-Aided Mol. Des.
, vol.10
, pp. 67-73
-
-
Montanari, C.A.1
Tute, M.S.2
Beezer, A.E.3
Mitchell, J.C.4
-
12
-
-
0003722376
-
-
Addison-Wesley Publishing Company, Inc.: Reading, MA
-
Goldberg, D. E. Genetic Algorithms in Search, Optimization, and Machine Learning; Addison-Wesley Publishing Company, Inc.: Reading, MA, 1989.
-
(1989)
Genetic Algorithms in Search, Optimization, and Machine Learning
-
-
Goldberg, D.E.1
-
13
-
-
0029970338
-
Evolutionary optimization in quantitative structure-activity relationship: An application of Genetic Neural Networks
-
So, S.-S.; Karplus, M. Evolutionary Optimization in Quantitative Structure-Activity Relationship: An Application of Genetic Neural Networks. J. Med. Chem. 1996, 39, 1521-1530.
-
(1996)
J. Med. Chem.
, vol.39
, pp. 1521-1530
-
-
So, S.-S.1
Karplus, M.2
-
15
-
-
0027363642
-
QSAR's from similarity matrixes. Technique validation and application in the comparison of different similarity evaluation methods
-
Good, A. C.; Peterson, S. J.; Richards, W. G. QSAR's from Similarity Matrixes. Technique Validation and Application in the Comparison of Different Similarity Evaluation Methods. J. Med. Chem. 1993, 36, 2929-2937.
-
(1993)
J. Med. Chem.
, vol.36
, pp. 2929-2937
-
-
Good, A.C.1
Peterson, S.J.2
Richards, W.G.3
-
16
-
-
0028881712
-
Quantitative structure-activity relationships (QSARs) of N-terminus fragments of NK1 tachykinin antagonists: A comparison of classical QSARs and three-dimensional QSARs from similarity matrices
-
Horwell, D. C.; Howson, W.; Higginbottom, M.; Naylor, D.; Ratcliffe, G. S.; Williams, S. Quantitative Structure-Activity Relationships (QSARs) of N-Terminus Fragments of NK1 Tachykinin Antagonists: A Comparison of Classical QSARs and Three-Dimensional QSARs from Similarity Matrices. J. Med. Chem. 1995, 38, 4454-4462.
-
(1995)
J. Med. Chem.
, vol.38
, pp. 4454-4462
-
-
Horwell, D.C.1
Howson, W.2
Higginbottom, M.3
Naylor, D.4
Ratcliffe, G.S.5
Williams, S.6
-
17
-
-
0026738394
-
Application of neural networks: Quantitative structure-activity relationships of the derivatives of 2,4-Diamino-5-(substituted-benzyl)pyrimidines as DHFR inhibitors
-
So, S.-S.; Richards, W. G. Application of Neural Networks: Quantitative Structure-Activity Relationships of the Derivatives of 2,4-Diamino-5-(substituted-benzyl)pyrimidines as DHFR Inhibitors. J. Med. Chem. 1992, 35, 3201-3207.
-
(1992)
J. Med. Chem.
, vol.35
, pp. 3201-3207
-
-
So, S.-S.1
Richards, W.G.2
-
18
-
-
0026075594
-
Applications of neural networks in quantitative structure-activity relationships of dihydrofolate reductase inhibitors
-
Andrea, T. A.; Kalayeh, H. Applications of Neural Networks in Quantitative Structure-Activity Relationships of Dihydrofolate Reductase Inhibitors. J. Med. Chem. 1991, 34, 2824-2836.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 2824-2836
-
-
Andrea, T.A.1
Kalayeh, H.2
-
19
-
-
84987090159
-
Molecular similarity based on electrostatic potential and electric field
-
Hodgkin, E. E.; Richards, W. G. Molecular similarity based on electrostatic potential and electric field. Int. J. Quantum Chem., Quantum Biol. Symp. 1987. 14, 105-110.
-
(1987)
Int. J. Quantum Chem., Quantum Biol. Symp.
, vol.14
, pp. 105-110
-
-
Hodgkin, E.E.1
Richards, W.G.2
-
21
-
-
0003686919
-
-
Biosym/MSI, San Diego
-
InsightII release 97.0, Biosym/MSI, San Diego, 1997.
-
(1997)
InsightII Release 97.0
-
-
-
22
-
-
0025390935
-
MOPAC - A semiempirical molecular orbital program
-
Stewart, J. J. P. MOPAC - A Semiempirical Molecular Orbital Program. J. Comput.-Aided Mol. Des. 1990, 4, 1-45.
-
(1990)
J. Comput.-aided Mol. Des.
, vol.4
, pp. 1-45
-
-
Stewart, J.J.P.1
-
23
-
-
0342819209
-
-
unpublished results
-
Heisterberg, D. J., 1990, unpublished results.
-
(1990)
-
-
Heisterberg, D.J.1
-
24
-
-
0027205884
-
A scaled conjugate gradient algorithm for fast supervised learning
-
Møller, M. F. A Scaled Conjugate Gradient Algorithm for Fast Supervised Learning. Neural Networks 1993, 525-533.
-
(1993)
Neural Networks
, pp. 525-533
-
-
Møller, M.F.1
-
25
-
-
0342819208
-
-
Available from author (T.B.) on request
-
Available from author (T.B.) on request.
-
-
-
-
26
-
-
84986532359
-
Synthesis of 2-Chloro-4,6-di(heteroaryl)pyrimidines
-
Strekowski, L.; Harden, D. B.; Grubb, W. B.; Patterson, S. E.; Czarny, A.; Mokrosz, M. J.; Cegła, M. T.; Wydra, R. L. Synthesis of 2-Chloro-4,6-di(heteroaryl)pyrimidines. J. Heterocycl. Chem. 1990, 27, 1393-1400.
-
(1990)
J. Heterocycl. Chem.
, vol.27
, pp. 1393-1400
-
-
Strekowski, L.1
Harden, D.B.2
Grubb, W.B.3
Patterson, S.E.4
Czarny, A.5
Mokrosz, M.J.6
Cegła, M.T.7
Wydra, R.L.8
-
27
-
-
0027211828
-
2A receptor affinity of some 2- and 3-substituted 1,2,3,4-tetrahydro-β-carbolines
-
2A Receptor Affinity of Some 2-and 3-Substituted 1,2,3,4-Tetrahydro-β-carbolines. Pharmazie 1993, 48, 289-294.
-
(1993)
Pharmazie
, vol.48
, pp. 289-294
-
-
Bojarski, A.J.1
Cegla, M.T.2
Charakchieva-Minol, S.3
Mokrosz, M.J.4
Maækowiak, M.5
Misztal, S.6
Mokrosz, J.L.7
-
28
-
-
0034181727
-
Characteristics of the ligand-binding site interaction for a series of arecoline-derived muscarinic agonists: A quantum chemical study
-
in press
-
Brocławik, E.; Borowski, T. Characteristics of the Ligand-Binding Site Interaction for a Series of Arecoline-Derived Muscarinic Agonists: A Quantum Chemical Study. Comput. Chem., in press.
-
Comput. Chem.
-
-
Brocławik, E.1
Borowski, T.2
-
29
-
-
0026560899
-
-
Wydra, R. L.; Harden, D. B.; Strekowski, L.; Battiste, M. A.; Coxon, J. M. Tetrahedron 1992, 48, 3485-3494.
-
(1992)
Tetrahedron
, vol.48
, pp. 3485-3494
-
-
Wydra, R.L.1
Harden, D.B.2
Strekowski, L.3
Battiste, M.A.4
Coxon, J.M.5
-
30
-
-
0025866199
-
Synthesis and quantitative structure-activity relationship analysis of 2-(Aryl or Heteroaryl)quinolin-4-amines, a new class of Anti-HIV-1 agents
-
Strekowski, L.; Mokrosz, J. L.; Honkan, V. A.; Czarny, A.; Cegła, M. T.; Wydra, R. L.; Patterson, S. E.; Schinazi, R. F. Synthesis and Quantitative Structure-Activity Relationship Analysis of 2-(Aryl or Heteroaryl)quinolin-4-amines, a New Class of Anti-HIV-1 Agents. J. Med. Chem. 1991, 34, 1739-1746.
-
(1991)
J. Med. Chem.
, vol.34
, pp. 1739-1746
-
-
Strekowski, L.1
Mokrosz, J.L.2
Honkan, V.A.3
Czarny, A.4
Cegła, M.T.5
Wydra, R.L.6
Patterson, S.E.7
Schinazi, R.F.8
-
31
-
-
0020004528
-
3H-ligand for serotonin 2 receptor binding sites. Binding properties, Brain distribution, and functional role
-
3H-Ligand for Serotonin 2 Receptor Binding Sites. Binding Properties, Brain Distribution, and Functional Role. Mol. Pharmacol. 1982, 21, 301-314.
-
(1982)
Mol. Pharmacol.
, vol.21
, pp. 301-314
-
-
Leysen, J.E.1
Niemegeers, C.J.E.2
Van Nueten, J.M.3
Laduron, P.M.4
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