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Visualization of a multidimensional descriptor space

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dc.contributor.author Gaspar H.
dc.contributor.author Baskin I.
dc.contributor.author Varnek A.
dc.date.accessioned 2018-09-19T21:52:51Z
dc.date.available 2018-09-19T21:52:51Z
dc.date.issued 2016
dc.identifier.issn 0097-6156
dc.identifier.uri https://dspace.kpfu.ru/xmlui/handle/net/144443
dc.description.abstract © 2016 American Chemical Society.In this chapter, we review some concepts and techniques used to visualize chemical compounds represented as objects in a multidimensional descriptor space. Several modern dimensionality reduction techniques are compared with respect to their ability to visualize the data in 2D space, using as example a dataset of acetylcholinesterase inhibitors and their decoys.
dc.relation.ispartofseries ACS Symposium Series
dc.title Visualization of a multidimensional descriptor space
dc.type Chapter
dc.relation.ispartofseries-volume 1222
dc.collection Публикации сотрудников КФУ
dc.relation.startpage 243
dc.source.id SCOPUS00976156-2016-1222-SID84990852441


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  • Публикации сотрудников КФУ Scopus [24551]
    Коллекция содержит публикации сотрудников Казанского федерального (до 2010 года Казанского государственного) университета, проиндексированные в БД Scopus, начиная с 1970г.

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