Consensus methods for virtual screening and clustering of chemical structure databases
The main combination procedures for chemoinformatics are combinations of multiple molecular descriptors, multiple similarity measures, multiple active reference molecules (queries) and multiple clustering methods. The combination methods provide better results for virtual screening because differe...
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2015
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Online Access: | http://eprints.utm.my/id/eprint/58146/ http://jchps.com/issues/Volume%208_Issue%201/jchps%208(1)%2020%20Faisal%20saeed%20112-116.pdf |
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my.utm.581462022-03-06T05:03:40Z http://eprints.utm.my/id/eprint/58146/ Consensus methods for virtual screening and clustering of chemical structure databases Saeed, Faisal Salim, Naomie Shamsir, Mohd. Shahir QA75 Electronic computers. Computer science The main combination procedures for chemoinformatics are combinations of multiple molecular descriptors, multiple similarity measures, multiple active reference molecules (queries) and multiple clustering methods. The combination methods provide better results for virtual screening because different descriptors, measures, or queries can provide different sources of evidence. In this paper, we review the recent work of combination methods for chemical structure databases SPB Pharma Society 2015 Article PeerReviewed Saeed, Faisal and Salim, Naomie and Shamsir, Mohd. Shahir (2015) Consensus methods for virtual screening and clustering of chemical structure databases. Journal Of Chemical And Pharmaceutical Sciences, 8 (1). pp. 112-116. ISSN 0973-4562 http://jchps.com/issues/Volume%208_Issue%201/jchps%208(1)%2020%20Faisal%20saeed%20112-116.pdf |
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QA75 Electronic computers. Computer science Saeed, Faisal Salim, Naomie Shamsir, Mohd. Shahir Consensus methods for virtual screening and clustering of chemical structure databases |
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The main combination procedures for chemoinformatics are combinations of multiple molecular descriptors, multiple similarity measures, multiple active reference molecules (queries) and multiple clustering methods. The combination methods provide better results for virtual screening because different descriptors, measures, or queries can provide different sources of evidence. In this paper, we review the recent work of combination methods for chemical structure databases |
format |
Article |
author |
Saeed, Faisal Salim, Naomie Shamsir, Mohd. Shahir |
author_facet |
Saeed, Faisal Salim, Naomie Shamsir, Mohd. Shahir |
author_sort |
Saeed, Faisal |
title |
Consensus methods for virtual screening and clustering of chemical structure databases |
title_short |
Consensus methods for virtual screening and clustering of chemical structure databases |
title_full |
Consensus methods for virtual screening and clustering of chemical structure databases |
title_fullStr |
Consensus methods for virtual screening and clustering of chemical structure databases |
title_full_unstemmed |
Consensus methods for virtual screening and clustering of chemical structure databases |
title_sort |
consensus methods for virtual screening and clustering of chemical structure databases |
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SPB Pharma Society |
publishDate |
2015 |
url |
http://eprints.utm.my/id/eprint/58146/ http://jchps.com/issues/Volume%208_Issue%201/jchps%208(1)%2020%20Faisal%20saeed%20112-116.pdf |
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1728051329739259904 |
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