(Q34289760)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

8 February 2020

title

Advances in computational methods to predict the biological activity of compounds (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

8 February 2020

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

Chartchalerm Isarankura-Na-Ayudhya

8 February 2020

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

Virapong Prachayasittikul

8 February 2020

series ordinal

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

8 February 2020

author name string

Virapong Prachayasittikul

series ordinal

3

1 reference

1 August 2017

language of work or name

English

0 references

publication date

22 May 2010

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

Expert Opinion on Drug Discovery

8 February 2020

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

8 February 2020

volume

5

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

8 February 2020

issue

7

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

8 February 2020

page(s)

633-654

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:22823204%20AND%20SRC:MED&resulttype=core&format=json

Fulfilling the promise: drug discovery in the post-genomic era.

8 February 2020

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Considerations and recent advances in QSAR models for cytochrome P450-mediated drug metabolism prediction

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The importance of outlier detection and training set selection for reliable environmental QSAR predictions.

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Definition and detection of outliers in chemical space

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Contemporary QSAR classifiers compared.

21 January 2018

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Comparison of support vector machine and artificial neural network systems for drug/nondrug classification

21 January 2018

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Comparative study of QSAR/QSPR correlations using support vector machines, radial basis function neural networks, and multiple linear regression.

21 January 2018

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A comparison of decision tree ensemble creation techniques.

21 January 2018

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Boosting: an ensemble learning tool for compound classification and QSAR modeling

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21 January 2018

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21 January 2018

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21 January 2018

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21 January 2018

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21 January 2018

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On some aspects of validation of predictive quantitative structure-activity relationship models

21 January 2018

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The Importance of Being Earnest: Validation is the Absolute Essential for Successful Application and Interpretation of QSPR Models

21 January 2018

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21 January 2018

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Three-dimensional quantitative similarity-activity relationships (3D QSiAR) from SEAL similarity matrices.

21 January 2018

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21 January 2018

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How to do an evaluation: pitfalls and traps

21 January 2018

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The meaning and use of the area under a receiver operating characteristic (ROC) curve

21 January 2018

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Predictive QSAR modeling workflow, model applicability domains, and virtual screening

21 January 2018

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On the interpretation and interpretability of quantitative structure-activity relationship models

21 January 2018

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Interpreting computational neural network QSAR models: a measure of descriptor importance.

21 January 2018

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On the Physical Interpretation of QSAR Models

21 January 2018

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On Outliers and Activity Cliffs - Why QSAR Often Disappoints

21 January 2018

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Structural interpretation of activity cliffs revealed by systematic analysis of structure-activity relationships in analog series

21 January 2018

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SAR index: quantifying the nature of structure-activity relationships

21 January 2018

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Structure−Activity Landscape Index: Identifying and Quantifying Activity Cliffs

21 January 2018

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Characterization of activity landscapes using 2D and 3D similarity methods: consensus activity cliffs

21 January 2018

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Enhanced SAR maps: expanding the data rendering capabilities of a popular medicinal chemistry tool.

21 January 2018

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On two novel parameters for validation of predictive QSAR models.

21 January 2018

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3D-QSAR study of 20 (S)-camptothecin analogs

21 January 2018

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A Tutorial on Support Vector Machines for Pattern Recognition

21 January 2018

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QSAR MODEL OF THE QUORUM-QUENCHING N-ACYL-HOMOSERINE LACTONE LACTONASE ACTIVITY

21 January 2018

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Molecular Descriptors for Chemoinformatics

21 January 2018

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Ant colony optimization theory: A survey

21 January 2018

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The Better Predictive Model: High q2 for the Training Set or Low Root Mean Square Error of Prediction for the Test Set?

21 January 2018

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