Quantitative Prediction of logkof Peptides in High-Performance Liquid Chromatography Based on Molecular Descriptors by Using the Heuristic Method and Support Vector Machine

H. X. Liu; C. X. Xue; R. S. Zhang; X. J. Yao; M. C. Liu; Z. D. Hu; B. T. Fan

doi:10.1021/ci049891a

Quantitative Prediction of logkof Peptides in High-Performance Liquid Chromatography Based on Molecular Descriptors by Using the Heuristic Method and Support Vector Machine

Journal of Chemical Information and Computer Sciences ◽

10.1021/ci049891a ◽

2004 ◽

Vol 44 (6) ◽

pp. 1979-1986 ◽

Cited By ~ 30

Author(s):

H. X. Liu ◽

C. X. Xue ◽

R. S. Zhang ◽

X. J. Yao ◽

M. C. Liu ◽

...

Keyword(s):

Support Vector Machine ◽

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Molecular Descriptors ◽

Heuristic Method ◽

Quantitative Prediction ◽

Support Vector

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Quantitative Prediction of logk of Peptides in High-Performance Liquid Chromatography Based on Molecular Descriptors by Using the Heuristic Method and Support Vector Machine.

ChemInform ◽

10.1002/chin.200506222 ◽

2005 ◽

Vol 36 (6) ◽

Author(s):

H. X. Liu ◽

C. X. Xue ◽

R. S. Zhang ◽

X. J. Yao ◽

M. C. Liu ◽

...

Keyword(s):

Support Vector Machine ◽

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Molecular Descriptors ◽

Heuristic Method ◽

Quantitative Prediction ◽

Support Vector

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Multivariate calibration with theoretical molecular descriptors for the prediction of diastereomer separation by high-performance liquid chromatography

Chemometrics and Intelligent Laboratory Systems ◽

10.1016/0169-7439(92)90049-l ◽

1992 ◽

Vol 17 (2) ◽

pp. 223-231 ◽

Cited By ~ 6

Author(s):

Göran Hansson ◽

Martin Ahnoff

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Molecular Descriptors ◽

Multivariate Calibration ◽

Diastereomer Separation

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Quantitative structure–retention relationships of pesticides in reversed-phase high-performance liquid chromatography based on WHIM and GETAWAY molecular descriptors

Analytica Chimica Acta ◽

10.1016/j.aca.2008.09.018 ◽

2008 ◽

Vol 628 (2) ◽

pp. 162-172 ◽

Cited By ~ 15

Author(s):

Angelo Antonio D’Archivio ◽

Maria Anna Maggi ◽

Pietro Mazzeo ◽

Fabrizio Ruggieri

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Molecular Descriptors ◽

Reversed Phase ◽

Quantitative Structure ◽

Structure Retention ◽

Quantitative Structure Retention Relationships

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Evaluating the performances of quantitative structure-retention relationship models with different sets of molecular descriptors and databases for high-performance liquid chromatography predictions

Journal of Chromatography A ◽

10.1016/j.chroma.2009.04.064 ◽

2009 ◽

Vol 1216 (25) ◽

pp. 5030-5038 ◽

Cited By ~ 17

Author(s):

Chunlei Wang ◽

Michael J. Skibic ◽

Richard E. Higgs ◽

Ian A. Watson ◽

Hai Bui ◽

...

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Molecular Descriptors ◽

Quantitative Structure ◽

Structure Retention ◽

Quantitative Structure Retention Relationship

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Quantitative analysis of ascorbic acid-2-sulfate by high-performance liquid chromatography with electrochemical detection

Journal of Chromatography A ◽

10.1016/s0021-9673(01)87558-0 ◽

1998 ◽

Vol 308 ◽

pp. 306-309

Author(s):

C Tsao

Keyword(s):

Ascorbic Acid ◽

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

Quantitative Analysis ◽

Electrochemical Detection ◽

High Performance

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Application of reversed-phase high-performance liquid chromatography for radioimmunoassay of plasma 18-hydroxycorticosterone

Journal of Chromatography A ◽

10.1016/s0021-9673(01)87556-7 ◽

1998 ◽

Vol 308 ◽

pp. 295-300 ◽

Cited By ~ 1

Author(s):

N Imaizumi

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Reversed Phase

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Determination of glaucine in plasma and urine by high-performance liquid chromatography

Journal of Chromatography A ◽

10.1016/s0021-9673(01)87553-1 ◽

1998 ◽

Vol 308 ◽

pp. 273-281

Author(s):

J Fels

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance

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Determination of progabide and its main acid metabolite in biological fluids using high-performance liquid chromatography and electrochemical detection Application to the measurement of blood/plasma partition ratio

Journal of Chromatography A ◽

10.1016/s0021-9673(01)87549-x ◽

1998 ◽

Vol 308 ◽

pp. 229-239

Author(s):

P Padovani

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

Blood Plasma ◽

Electrochemical Detection ◽

High Performance ◽

Biological Fluids ◽

Partition Ratio ◽

Acid Metabolite

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Determination of cinnamaldehyde, coumarin and cinnamyl alcohol in cinnamon and cassia by high-performance liquid chromatography

Journal of Chromatography A ◽

10.1016/s0021-9673(01)91485-2 ◽

1988 ◽

Vol 447 (3) ◽

pp. 272-276 ◽

Cited By ~ 3

Author(s):

A Archer

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Cinnamyl Alcohol

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Indirect photometric detection of inorganic anions in micro high-performance liquid chromatography with permanently coated columns

Journal of Chromatography A ◽

10.1016/s0021-9673(01)91475-x ◽

1988 ◽

Vol 447 (3) ◽

pp. 221-224 ◽

Cited By ~ 4

Author(s):

T Takeuchi

Keyword(s):

High Performance Liquid Chromatography ◽

Liquid Chromatography ◽

High Performance ◽

Inorganic Anions ◽

Indirect Photometric Detection ◽

Photometric Detection

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