Cargando…
Benchmarking of protein descriptor sets in proteochemometric modeling (part 2): modeling performance of 13 amino acid descriptor sets
BACKGROUND: While a large body of work exists on comparing and benchmarking descriptors of molecular structures, a similar comparison of protein descriptor sets is lacking. Hence, in the current work a total of 13 amino acid descriptor sets have been benchmarked with respect to their ability of esta...
Autores principales: | van Westen, Gerard JP, Swier, Remco F, Cortes-Ciriano, Isidro, Wegner, Jörg K, Overington, John P, IJzerman, Adriaan P, van Vlijmen, Herman WT, Bender, Andreas |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2013
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4015169/ https://www.ncbi.nlm.nih.gov/pubmed/24059743 http://dx.doi.org/10.1186/1758-2946-5-42 |
Ejemplares similares
-
Benchmarking of protein descriptor sets in proteochemometric modeling (part 1): comparative study of 13 amino acid descriptor sets
por: van Westen, Gerard JP, et al.
Publicado: (2013) -
Proteochemometric modeling in a Bayesian framework
por: Cortes-Ciriano, Isidro, et al.
Publicado: (2014) -
Significantly Improved HIV Inhibitor Efficacy Prediction Employing Proteochemometric Models Generated From Antivirogram Data
por: van Westen, Gerard J. P., et al.
Publicado: (2013) -
Prediction of the potency of mammalian cyclooxygenase inhibitors with ensemble proteochemometric modeling
por: Cortes-Ciriano, Isidro, et al.
Publicado: (2015) -
Which Compound to Select in Lead Optimization? Prospectively Validated Proteochemometric Models Guide Preclinical Development
por: van Westen, Gerard J. P., et al.
Publicado: (2011)