(Q79217779)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

title

A novel workflow for the inverse QSPR problem using multiobjective optimization (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

Quantitative Structure–Property Relationship

20 December 2019

main subject

1 reference

Nathan Brown

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

Ben McKay

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

Johann Gasteiger

series ordinal

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

publication date

1 May 2006

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

Journal of Computer - Aided Molecular Design

20 December 2019

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

volume

20

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

issue

5

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

page(s)

333-341

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

https://scigraph.springernature.com/pub.10.1007/s10822-006-9063-1

20 December 2019

exact match

0 references

cites work

A graph-based genetic algorithm and its application to the multiobjective evolution of median molecules.

1 reference

12 December 2020

Searching for scalable processes: addressing the challenges in times of increasing complexity.

1 reference

12 December 2020

Computer-based de novo design of drug-like molecules

1 reference

12 December 2020

Superposition of three-dimensional chemical structures allowing for conformational flexibility by a hybrid method.

1 reference

12 December 2020

Aqueous solubility prediction of drugs based on molecular topology and neural network modeling.

1 reference

12 December 2020

A comparison of methods for modeling quantitative structure-activity relationships

1 reference

12 December 2020

Advances in multivariate analysis in pharmaceutical process development.

1 reference

12 December 2020

The de novo design of median molecules within a property range of interest

1 reference

12 December 2020

Virtual darwinian drug design: QSAR inverse problem, virtual combinatorial chemistry, and computational screening

1 reference

12 December 2020

Genetic algorithm for the design of molecules with desired properties

1 reference

12 December 2020

Generation of multiple pharmacophore hypotheses using multiobjective optimisation techniques

1 reference

12 December 2020

Optimizing the size and configuration of combinatorial libraries

1 reference

12 December 2020

Methods for reliability and uncertainty assessment and for applicability evaluations of classification- and regression-based QSARs

1 reference

12 December 2020

10.1007/S10822-006-9063-1

Identifiers

DOI

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:17031542%20AND%20SRC:MED&resulttype=core&format=json

20 December 2019

DBLP publication ID

journals/jcamd/BrownMG06

1 reference

DBLP Dataset 2021-01-02

release_vcdjf7vmanewbdigusijiperjm

28 January 2021

Fatcat ID

0 references

1 reference