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Quantitative structure–activity relationship

Known as: QSAR paradox, Quantitative structure-property relationship, QSPR 
Quantitative structure–activity relationship models (QSAR models) are regression or classification models used in the chemical and biological… 
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Papers overview

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Highly Cited
2016
Highly Cited
2016
Editorial: In the present editorial, Quantitative Structure Activity Relationship (QSAR) and Quantitative Structure Properties… 
Highly Cited
2011
Highly Cited
2011
Fullerenes are sparingly soluble in many solvents. The dependence of fullerene’s solubility on molecular structure of the solvent… 
2004
2004
Summary form only given. A successful approach to building QSAR models was proposed by other researchers. It uses binary particle… 
2003
2003
In order to accomplish further refinement over the TAU formalism in the valence electron mobile (VEM) environment, some of the… 
Review
2002
Review
2002
Fragmental methods (FMs) have great potential in many practical areas related to the design of new lead compounds. Advanced… 
Highly Cited
1999
Highly Cited
1999
The selection of the most relevant variable is a frequent problem in the analysis of chemical data, especially now considering… 
1998
1998
A general five parameter quantitative structure−property relationship (QSPR) model (R2 = 0.945, s = 0.0155) is described for the… 
Highly Cited
1996
Highly Cited
1996
Edge adjacency relationships in molecular graphs have been used to define a new topographic index. The novel index is calculated…