Molecular Descriptors Family on Structure-Activity Relationships on anti-HIV-1 Potencies of HEPTA and TIBO Derivatives
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CONTRIBUTORS:
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PROCEEDINGS TITLE:
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YEAR:
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2006
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PUB TYPE:
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Conference Paper in Proceedings
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PAGES:
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110 -
114
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SUBJECT(S):
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chemistry - computational; informatics - applied; mathematics - statistics; medicine - immunology; medicine - informatics
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DISCIPLINE:
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Medicine
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HTTP:
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http://lori.academicdirect.org/works/?id=85
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LANGUAGE:
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English
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PUB ID:
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103-436-056
(Last edited on
2007/07/08 07:11:02 GMT-6)
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SPONSOR(S):
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ABSTRACT:
A new developed methodology of Structure-Activity Relationships (SAR) was applied on a set of 57 compounds with known inhibition activity of immunodeficiency virus type 1. The methodology uses an original family of molecular structure descriptors called Molecular Descriptors Family. With a set of multiple linear regression analysis programs, the whole set of MDF members were crossed in order to find the best SAR model. The obtained model allows making important remarks on structure-activity links. The disadvantage of time consuming to analyze the entire set of descriptors is compensated by better structure-activity relationships.
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STATISTICS
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