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QSPR i QSAR supstituiranih ftalimida
1999U ovome radu provedena su QSPR i QSAR istraživanja nekoliko nizova supstituiranih ftalimida, od kojih je većina pripremljena na našem fakultetu.Koristeći topologijske indekse i razne fizičko-kemijske parametre kao parametre aktivnosti dobiveni su značajni QSPR iQSAR modeli koji predviđaju aktivnost nekih novih ftalimida.
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2013
The main goals of our study were 1) modification and adaptation of the SiRMS-approach to QSPR-analysis of mixtures of compounds, 2) its application to the analysis of the boiling and condensation temperatures of various binary mixtures. The rigorous external validation shows that the obtained models are well-suitable (accuracy of ??7 ??) for the gap ...
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The main goals of our study were 1) modification and adaptation of the SiRMS-approach to QSPR-analysis of mixtures of compounds, 2) its application to the analysis of the boiling and condensation temperatures of various binary mixtures. The rigorous external validation shows that the obtained models are well-suitable (accuracy of ??7 ??) for the gap ...
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2011
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QSAR/QSPR Modeling: Introduction
2015Development of predictive quantitative structure–activity relationship (QSAR) models plays a significant role in the design of purpose-specific fine chemicals including pharmaceuticals. Considering the wide application of different types of chemicals in human life, QSAR modeling is a useful tool for prediction of biological activity, physicochemical ...
Kunal Roy +2 more
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2015
The QSAR/QSPR technique is now a widely practiced tool in chemical research both in the industry and academia. Because of the enormous potential applications of predictive modeling analysis, various newer methods have recently been developed to improve the usefulness and applicability of QSAR techniques.
Kunal Roy +2 more
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The QSAR/QSPR technique is now a widely practiced tool in chemical research both in the industry and academia. Because of the enormous potential applications of predictive modeling analysis, various newer methods have recently been developed to improve the usefulness and applicability of QSAR techniques.
Kunal Roy +2 more
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On Topological Indices and QSPR Analysis of Drugs Used for the Treatment of Breast Cancer
Polycyclic Aromatic Compounds, 2022Muhammad Kamran Siddiqui +2 more
exaly
2014 IEEE International Workshop on Machine Learning for Signal Processing (MLSP), 2014
Duprat, A. +3 more
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Duprat, A. +3 more
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