Chemometrics in Medicine and Pharmacy
暂无分享,去创建一个
[1] M. Uschold,et al. Methods and applications , 1953 .
[2] D. Borošová,et al. Validation and Quality Assurance of Arsenic Determination in Urine by GFAAS after Toluene Extraction , 2002 .
[3] Mark T. D. Cronin,et al. QSAR in Toxicology. 4. Prediction of Non‐lethal Mammalian Toxicological Endpoints, and Expert Systems for Toxicity Prediction , 1995 .
[4] A Gallegos Saliner. Mini-Review on Chemical Similarity and Prediction of Toxicity , 2006 .
[5] Serge Kokot,et al. Application of high performance liquid chromatography for the profiling of complex chemical mixtures with the aid of chemometrics. , 2007, Talanta.
[6] Elaine Holmes,et al. Statistical total correlation spectroscopy editing of 1H NMR spectra of biofluids: application to drug metabolite profile identification and enhanced information recovery. , 2009, Analytical chemistry.
[7] John D. Walker,et al. Use of QSARs in international decision-making frameworks to predict health effects of chemical substances. , 2003, Environmental health perspectives.
[8] W Vycudilik,et al. Prediction of gas chromatographic retention indices of a diverse set of toxicologically relevant compounds. , 2004, Journal of chromatography. A.
[9] J. Mocák,et al. Chemometrical analysis of computed QSAR parameters and their use in biological activity prediction , 2009 .
[10] J C Boyd. Perspectives on the use of chemometrics in laboratory medicine. , 1986, Clinical chemistry.
[11] R. G. Ackman. Structure and Retention Time in the Gas-liquid Chromatography of Unsaturated Fatty Acids on Polyester Substrates , 1962, Nature.
[12] Thomas Steger-Hartmann,et al. Use of computer-assisted prediction of toxic effects of chemical substances. , 2006, Toxicology.
[13] Ł. Komsta. Chemometrics in Fingerprinting by Means of Thin Layer Chromatography , 2012 .
[14] Mark Walker,et al. Optimization of human plasma 1H NMR spectroscopic data processing for high-throughput metabolic phenotyping studies and detection of insulin resistance related to type 2 diabetes. , 2008, Analytical chemistry.
[15] Kenneth M. Merz,et al. Drug Design : Structure-and Ligand-Based Approaches , 2017 .
[16] K. Héberger. Quantitative structure-(chromatographic) retention relationships. , 2007, Journal of chromatography. A.
[17] Gallegos Saliner Ana. Mini-Review on Chemical Similarity and Prediction of Toxicity , 2006 .
[18] James C Boyd,et al. Defining laboratory reference values and decision limits: populations, intervals, and interpretations. , 2010, Asian journal of andrology.
[19] Johan Trygg,et al. Dynamic modelling of time series data in nutritional metabonomics — A powerful complement to randomized clinical trials in functional food studies , 2010 .
[20] Richard G. Brereton,et al. Applied Chemometrics for Scientists , 2007 .
[21] J. Drews. Drug discovery: a historical perspective. , 2000, Science.
[22] J. Mocák,et al. Use of multidimensional data analysis for prediction of lung malignity. , 2009, Journal of pharmaceutical and biomedical analysis.
[23] D. Gauguier,et al. Statistical total correlation spectroscopy: an exploratory approach for latent biomarker identification from metabolic 1H NMR data sets. , 2005, Analytical chemistry.
[24] J. Henny,et al. Reference intervals for serum creatinine concentrations: assessment of available data for global application. , 2008, Clinical chemistry.
[25] J. Mocák,et al. Chemometrical study of the anaesthetical activity of alkoxyphenylcarbamic acid esters. , 2010, Die Pharmazie.
[26] Mark T. D. Cronin,et al. Recent Advances in QSAR Studies , 2010 .
[27] Qing-Song Xu,et al. Chemometrics and modernization of traditional Chinese medicine , 2008 .
[28] G. Downey,et al. Review: The Application of near Infrared Spectroscopy to the Measurement of Bioactive Compounds in Food Commodities , 2010 .
[29] L Körmendy,et al. Comparison of analytical methods. , 1989, Meat science.
[30] J. Mocák,et al. Effect of the statin therapy on biochemical laboratory tests--a chemometrics study. , 2011, Journal of pharmaceutical and biomedical analysis.
[31] J. Mocák,et al. QSRR models for potential local anaesthetic drugs using high performance liquid chromatography. , 2012, Journal of pharmaceutical and biomedical analysis.
[32] J C Boyd,et al. Mathematical tools for demonstrating the clinical usefulness of biochemical markers. , 1997, Scandinavian journal of clinical and laboratory investigation. Supplementum.
[33] Eszter Bohus,et al. Cluster analysis statistical spectroscopy using nuclear magnetic resonance generated metabolic data sets from perturbed biological systems. , 2009, Analytical chemistry.
[34] R. Todeschini,et al. Molecular Descriptors for Chemoinformatics: Volume I: Alphabetical Listing / Volume II: Appendices, References , 2009 .
[35] PREDICTION OF HPLC RETENTION FACTOR OF POTENTIAL ANTITUBERCULOTICS BY QSRR , 2011 .
[36] Mark T. D. Cronin,et al. QSAR in Toxicology. 2. Prediction of Acute Mammalian Toxicity and Interspecies Correlations , 1995 .
[37] Alan R. Katritzky,et al. Theoretical Descriptors for the Correlation of Aquatic Toxicity of Environmental Pollutants by Quantitative Structure—Toxicity Relationships. , 2001 .
[38] Milon Tichy,et al. QSAR IN TOXICOLOGY , 1980 .
[39] Mark T. D. Cronin,et al. QSAR in Toxicology. 3. Prediction of Chronic Toxicities , 1995 .
[40] J. Mocák,et al. Relationship between administration of statins and blood serum levels of selected biochemical parameters , 2021, Nova Biotechnologica et Chimica.
[41] J. Mocák,et al. Prediction of anti-tuberculosis activity of 3-phenyl-2H-1,3-benzoxazine-2,4(3H)-dione derivatives , 2013, Chemical Papers.
[42] J. Mocák,et al. Comparative study of cardiovascular markers data by various techniques of multivariate analysis , 2004 .
[43] R Todeschini,et al. Molecular Descriptors for Chemoinformatics. Vol. 1. Alphabetical Listing; Vol. 2. Appendices, References , 2009 .
[44] Stephen J. Bruce,et al. Investigation of human blood plasma sample preparation for performing metabolomics using ultrahigh performance liquid chromatography/mass spectrometry. , 2009, Analytical chemistry.
[45] Maša Islamčević,et al. Correct ways of using regression for method comparison studies: Determination of LDL-cholesterol , 2005 .
[46] Mattias Rantalainen,et al. Analytic properties of statistical total correlation spectroscopy based information recovery in 1H NMR metabolic data sets. , 2009, Analytical chemistry.
[47] J. Mocák,et al. HPLC determination of morphine, morphine-3-glucuronide and morphine-6-glucuronide in human serum of oncological patients after administration of morphine drugs. , 2006, Die Pharmazie.
[48] Comparison of IFCC and NGSP methods for determination of glycated haemoglobin using advanced regression techniques , 2010 .
[49] J. Dearden,et al. QSAR in Toxicology. 1. Prediction of Aquatic Toxicity , 1995 .
[50] John C Lindon,et al. Robust algorithms for automated chemical shift calibration of 1D 1H NMR spectra of blood serum. , 2008, Analytical chemistry.