Potency-directed similarity searching using support vector machines
Main Authors: | Heikamp, Kathrin, Wassermann, Anne M, Bajorath, Jürgen |
---|---|
Format: | Online |
Language: | English |
Published: |
BioMed Central
2012
|
Online Access: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3341252/ |
Similar Items
-
Systematic Artifacts in Support Vector Regression-Based Compound Potency Prediction Revealed by Statistical and Activity Landscape Analysis
by: Balfer, Jenny, et al.
Published: (2015) -
Activity-relevant similarity values for fingerprints and implications for similarity searching
by: Jasial, Swarit, et al.
Published: (2016) -
A computational method to facilitate structure-activity relationship transfer
by: Wassermann, Anne Mai, et al.
Published: (2012) -
Statistical modeling of value distributions of similarity coefficients in virtual screening and its application to predicting fingerprint search performance
by: Vogt, Martin, et al.
Published: (2013) -
Foundations of molecular similarity analysis
by: Bajorath, Jürgen
Published: (2008)