Use of physicochemical parameters in distance geometry and related three-dimensional quantitative structure-activity relationships: A demonstration using Escherichia coli dihydrofolate reductase inhibitors

Arup K. Ghose; Gordon M. Crippen

doi:10.1021/jm00381a013

Use of physicochemical parameters in distance geometry and related three-dimensional quantitative structure-activity relationships: A demonstration using Escherichia coli dihydrofolate reductase inhibitors

Journal of Medicinal Chemistry ◽

10.1021/jm00381a013 ◽

1985 ◽

Vol 28 (3) ◽

pp. 333-346 ◽

Cited By ~ 62

Author(s):

Arup K. Ghose ◽

Gordon M. Crippen

Keyword(s):

Escherichia Coli ◽

Dihydrofolate Reductase ◽

Physicochemical Parameters ◽

Distance Geometry ◽

Three Dimensional ◽

Quantitative Structure ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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ChemInform Abstract: USE OF PHYSICOCHEMICAL PARAMETERS IN DISTANCE GEOMETRY AND RELATED THREE-DIMENSIONAL QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS: A DEMONSTRATION USING ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE INHIBITORS

Chemischer Informationsdienst ◽

10.1002/chin.198532378 ◽

1985 ◽

Vol 16 (32) ◽

Author(s):

A. K. GHOSE ◽

G. M. CRIPPEN

Keyword(s):

Escherichia Coli ◽

Dihydrofolate Reductase ◽

Physicochemical Parameters ◽

Distance Geometry ◽

Three Dimensional ◽

Quantitative Structure ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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ChemInform Abstract: QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS BY DISTANCE GEOMETRY: SYSTEMATIC ANALYSIS OF DIHYDROFOLATE REDUCTASE INHIBITORS

Chemischer Informationsdienst ◽

10.1002/chin.198042296 ◽

1980 ◽

Vol 11 (42) ◽

Author(s):

G. M. CRIPPEM

Keyword(s):

Dihydrofolate Reductase ◽

Distance Geometry ◽

Quantitative Structure ◽

Systematic Analysis ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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Quantitative structure-activity relationships by distance geometry: systematic analysis of dihydrofolate reductase inhibitors

Journal of Medicinal Chemistry ◽

10.1021/jm00180a004 ◽

1980 ◽

Vol 23 (6) ◽

pp. 599-606 ◽

Cited By ~ 35

Author(s):

Gordon M. Crippen

Keyword(s):

Dihydrofolate Reductase ◽

Distance Geometry ◽

Quantitative Structure ◽

Systematic Analysis ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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Applications of neural networks in quantitative structure-activity relationships of dihydrofolate reductase inhibitors

Journal of Medicinal Chemistry ◽

10.1021/jm00113a022 ◽

1991 ◽

Vol 34 (9) ◽

pp. 2824-2836 ◽

Cited By ~ 201

Author(s):

T. A. Andrea ◽

Hooshmand Kalayeh

Keyword(s):

Neural Networks ◽

Dihydrofolate Reductase ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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Evolutionary Neural Networks in Quantitative Structure-Activity Relationships of Dihydrofolate Reductase Inhibitors

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.19960150404 ◽

1996 ◽

Vol 15 (4) ◽

pp. 296-301 ◽

Cited By ~ 11

Author(s):

Jari KyngÃ¤s ◽

Jarkko Valjakka

Keyword(s):

Neural Networks ◽

Dihydrofolate Reductase ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Evolutionary Neural Networks ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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ChemInform Abstract: QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP BY DISTANCE GEOMETRY: QUINAZOLINES AS DIHYDROFOLATE REDUCTASE INHIBITORS

Chemischer Informationsdienst ◽

10.1002/chin.198304225 ◽

1983 ◽

Vol 14 (4) ◽

Author(s):

A. K. GHOSE ◽

G. M. CRIPPEN

Keyword(s):

Dihydrofolate Reductase ◽

Distance Geometry ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Reductase Inhibitors ◽

Structure Activity ◽

Dihydrofolate Reductase Inhibitors

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Quantitative Structure Activity Relationships of Dihydrofolate Reductase Inhibitors by Neural Networks

Protein Engineering Design and Selection ◽

10.1093/protein/6.supplement.107-b ◽

1993 ◽

Keyword(s):

Neural Networks ◽

Dihydrofolate Reductase ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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Quantitative structure-activity relationship by distance geometry: quinazolines as dihydrofolate reductase inhibitors

Journal of Medicinal Chemistry ◽

10.1021/jm00350a003 ◽

1982 ◽

Vol 25 (8) ◽

pp. 892-899 ◽

Cited By ~ 29

Author(s):

Arup K. Ghose ◽

Gordon M. Crippen

Keyword(s):

Dihydrofolate Reductase ◽

Distance Geometry ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Reductase Inhibitors ◽

Structure Activity ◽

Dihydrofolate Reductase Inhibitors

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Three-dimensional quantitative structure-activity and structure-selectivity relationships of dihydrofolate reductase inhibitors

Journal of Computer-Aided Molecular Design ◽

10.1023/b:jcam.0000047814.85293.da ◽

2004 ◽

Vol 18 (5) ◽

pp. 309-331 ◽

Cited By ~ 27

Author(s):

Jeffrey J. Sutherland ◽

Donald F. Weaver

Keyword(s):

Dihydrofolate Reductase ◽

Three Dimensional ◽

Quantitative Structure ◽

Reductase Inhibitors ◽

Structure Activity ◽

Dihydrofolate Reductase Inhibitors

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ChemInform Abstract: A GENERAL DISTANCE-GEOMETRY THREE-DIMENSIONAL RECEPTOR MODEL FOR DIVERSE DIHYDROFOLATE REDUCTASE INHIBITORS

Chemischer Informationsdienst ◽

10.1002/chin.198448347 ◽

1984 ◽

Vol 15 (48) ◽

Author(s):

A. K. GHOSE ◽

G. M. CRIPPEN

Keyword(s):

Dihydrofolate Reductase ◽

Distance Geometry ◽

Three Dimensional ◽

Receptor Model ◽

Reductase Inhibitors ◽

Dihydrofolate Reductase Inhibitors

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