On Complementary Approaches of Assessing the Predictive Potential of QSPR/QSAR Models
Challenges and advances in computational chemistry and physics(2023)
摘要
This chapter covers an overview of recent studies performed to improve the statistical tools to assess and compare different QSPR/QSAR models. The critical analysis of existing approaches to assess the predictive potential is briefly presented. The disadvantages of the systems of self-consistent modelsSelf-consistent model system are also discussed. The potential advantages of the systems of self-consistent models are defined. A series of successful applications of the approach for several endpoints are discussed in order to confirm the potential of the approach as a tool to validate QSAR models.
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关键词
qspr/qsar,qspr/qsar,predictive potential
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