Search Results - "Dunn, W. J"

Amino Acid Side Chain Descriptors for Quantitative Structure-Activity Relationship Studies of Peptide Analogs by Collantes, Elizabeth R, Dunn, William J

“…This report describes a new set of amino acid side chain descriptors, the isotropic surface area (ISA), and the electronic charge index (ECI) relevant to…”
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Consensus Molecular Alignment Based on Generalized Procrustes Analysis by Kroonenberg, P. M, Dunn, W. J, Commandeur, J. J. F

“…One of the most serious problems in three-dimensional quantitative structure−activity relationship (3D-QSAR) studies is selection of an alignment rule for…”
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The role of solvent-accessible surface area in determining partition coefficients by Dunn, W. J, Koehler, M. G, Grigoras, Stelian

“…The logarithm of the partition coefficient (log P) of low-molecular-weight organic compounds is a physicochemical parameter used extensively in…”
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Solution of the Conformation and Alignment Tensors for the Binding of Trimethoprim and Its Analogs to Dihydrofolate Reductase:  3D-Quantitative Structure−Activity Relationship Study Using Molecular Shape Analysis, 3-Way Partial Least-Squares Regression, and 3-Way Factor Analysis by Dunn, William J, Hopfinger, Anton J, Catana, Cornel, Duraiswami, Chaya

“…Molecular recognition is the basis of rational drug design, and for this reason it has been extensively studied. However, the process by which a ligand…”
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Misconceptions by Dunn, W J

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QSAR approaches to predicting toxicity by Dunn, 3rd, W J

“…Due to the demands of time and the high cost of testing compounds for toxicity in test animals, it would be an advantage to be able to estimate the toxic…”
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Pattern recognition for classification and determination of polychlorinated biphenyls in environmental samples by Dunn, W. J, Stalling, D. L, Schwartz, T. R, Hogan, J. W, Petty, J. D, Johansson, Erik, Wold, Svante

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Classification of polychlorinated biphenyl residues: isomers vs. homologue concentrations in modeling aroclors and polychlorinated biphenyl residues by STALLING, D. L, SCHWARTZ, T. R, DUNN, W. J. III, WOLD, S

“…SIMCA (soft independent modeling by class analogy), a principal components chemometric modeling program, was used to examine complex mixtures of…”
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Regional Development and Language Maintenance by Keane, M J, Griffith, B, Dunn, J W

“…The maintenance of cultural areas is inextricably connected to their ability to survive in economic terms. There is, however, an uneasy relationship between…”
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Structure-activity analyzed by pattern recognition: the asymmetric case by Dunn, W. J, Wold, Svante

“…In classification studies in which pattern-recognition methods are used to distinguish active compounds from inactive ones, a type of data structure which we…”
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A computer-assisted method for estimation of the partition coefficient. Monte Carlo simulations of the chloroform/water log P for methylamine, methanol, and acetonitrile by Dunn, W. J, Nagy, P. I, Collantes, E. R

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Surface roughness of various packable composites by Ryba, Timothy M, Dunn, William J, Murchison, David F

“…Packable composite restorations have become a popular alternative to dental amalgam restorations in posterior teeth. A drawback inherent to composites is their…”
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Relationship between gas chromatographic retention of polychlorinated dibenzofurans and calculated molecular surface area by Dunn, W. J, Koehler, Michael, Stalling, D. L, Schwartz, T. R

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Economic viability and animal health regulation effects on a large scale trout hatchery by Bacon, J.R., Gempesaw, C.M., Lussier, W.W., Dunn, J.W.

“…An economic-engineering approach is used to evaluate the economic viability and health regulatory effects on a trout egg production hatchery located in the…”
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Photoaffinity guanosine 5'-triphosphate analogs as a tool for the study of GTP-binding proteins by Rasenick, M M, Talluri, M, Dunn, 3rd, W J

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Establishing proximal contacts with pre-polymerized composite inserts by Dunn, William J

“…A technique of restoring Class II posterior restorations with resin-based composite and a pre-polymerized composite insert was presented. This technique is…”
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A structure-carcinogenicity study of 4-nitroquinoline 1-oxides using the SIMCA method of pattern recognition by Dunn, W. J, Wold, Svante

“…Structure-carcinogenicity data for a series of 4-nitro- and 4-hydroxyaminoquinoline 1-oxides were analyzed using the SIMCA method of pattern recognition. Using…”
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Structure-activity study of .beta.-adrenergic agents using the SIMCA method of pattern recognition by Dunn, W. J, Wold, Svante, Martin, Y. C

“…The SIMCA method of pattern recognition (PaRC) was used to analyze structure-activity data for a series of phenethylamine agonists and antagonists of the…”
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In vitro wear of various orthotic device materials by Casey, Jeffery, Dunn, William J, Wright, Edward

“…Orthotic devices are advocated to decrease occlusal attrition caused by bruxism but tend to wear with time. This study investigated the wear rate of various…”
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Classification of polychlorinated biphenyl residues: isomers vs. homolog concentrations in modeling Aroclors and polychlorinated biphenyl residues by Stalling, D. L, Schwartz, T. R, Dunn, W. J, Wold, Svante

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