(Q52077558)

English

Molecular descriptors for effective classification of biologically active compounds based on principal component analysis identified by a genetic algorithm

scientific article published in May 2000

In more languages

default for all languages

No label defined

No description defined

Statements

scholarly article

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

Molecular descriptors for effective classification of biologically active compounds based on principal component analysis identified by a genetic algorithm (English)

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

principal component analysis

0 references

author name string

Xue L

1

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

Bajorath J

2

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

publication date

1 May 2000

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

Journal of Chemical Information and Computer Sciences

0 references

40

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

3

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

801-809

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

Applications of the radius-diameter diagram to the classification of topological and geometrical shapes of chemical compounds

2 references

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI00008A012

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Clustering a large number of compounds. 1. Establishing the method on an initial sample

2 references

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI00062A004

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Indexes of molecular shape from chemical graphs

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Selecting optimally diverse compounds from structure databases: a validation study of two-dimensional and three-dimensional molecular descriptors

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Genetic algorithms: principles of natural selection applied to computation

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Chemical Similarity Searching

2 references

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI9800211

Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Evolutionary algorithms in computer-aided molecular design

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Enhancing the diversity of a corporate database using chemical database clustering and analysis

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Analysis of a large structure/biological activity data set using recursive partitioning

2 references

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI9903049

Computational methods in molecular diversity and combinatorial chemistry

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Database searching for compounds with similar biological activity using short binary bit string representations of molecules

2 references

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI990308D

Diversity assessment

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

Identification of Biological Activity Profiles Using Substructural Analysis and Genetic Algorithms

2 references

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI000322M

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI970431+

Identifiers

10.1021/CI000322M

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

DBLP publication ID

journals/jcisd/Bajorath00

1 reference

DBLP Dataset 2021-01-02

28 January 2021

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

21 April 2018

http://europepmc.org/abstract/MED/10850786

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

Retrieved from "https://www.wikidata.org/w/index.php?title=Q52077558&oldid=2288534931"