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From molecular structure to molecular design through the Molecular Descriptors Family Methodology

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CONTRIBUTORS:
  Author Bolboacă, Sorana D. (Iuliu Hatieganu University of Medicine and Pharmacy Cluj-Napoca)
  Author Jäntschi, Lorentz (Technical University of Cluj-Napoca)
BOOK TITLE:
  QSPR-QSAR Studies on Desired Properties for Drug Design
YEAR: 2010
PUB TYPE: Book Chapter
PAGES: 117 - 165
SUBJECT(S): chemistry - mathematical
DISCIPLINE: Chemistry
HTTP: http://lori.academicdirect.org/books/work_list.php?user=lori&id=255
LANGUAGE: English
PUB ID: 103-501-692 (Last edited on 2012/04/08 09:25:30 GMT-6)
SPONSOR(S):
 
ABSTRACT:
The Molecular Descriptors Family on the Structure-Property/Activity Relationships (MDF SPR/SAR) is an area of computational research able to generate a family of molecular descriptors and to build models in order to estimate and predict the property/activity of chemical compounds. This review aims to briefly present the MDF SPR/SAR methodology and to discuss its abilities to estimate and predict different properties and activities.
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