Concepedia

Support vector machine applied in QSAR modelling

Mei Hu, Yuan Zhou, Guizhao Liang, Zhiliang Li

Chinese Science Bulletin · 2005 · 36 citations · 16 references

Concepts

PharmacyChemistryMedicinal ChemistryComputational ChemistryDrug DiscoveryMachine LearningKernel MethodsMolecular DockingMolecular Property PredictionQuantitative Structure-activity RelationshipsSupport Vector MachinesVirtual ScreeningComputational Structure-activity ModelingMulticlass Support Vector MachinesSupport Vector Machine ClassificationSupport Vector Regression

References

16

Support-Vector Networks

Corinna Cortes, Vladimir Vapnik · Machine Learning · 1995 · 33K citations · Full text

Alexander Golbraikh, Alexander Tropsha · Journal of Molecular Graphics and Modelling · 2002 · 3.7K citations

The Importance of Being Earnest: Validation is the Absolute Essential for Successful Application and Interpretation of QSPR Models

Alexander Tropsha, Paola Gramatica, Vijay K. Gombar · QSAR & Combinatorial Science · 2003 · 2.2K citations

Pharmacy, Medicinal Chemistry, Drug Design +16

A novel method of protein secondary structure prediction with high segment overlap measure: support vector machine approach1 1Edited by B. Holland

Sujun Hua, Zhirong Sun · Journal of Molecular Biology · 2001 · 540 citations

Life Sciences, Biochemistry, Bioinformatics +8

INTRODUCTION TO STATISTICAL LEARNING THEORY AND SUPPORT VECTOR MACHINES

Zhang Xuegong · 2000 · 387 citations

Computing, Computer Science, Data Mining +9