search

Total posts by Central University of Las Villas: 4

publication · 3 months ago
Ligand-Based Virtual Screening Using Tailored Ensembles: A Prioritization Tool for Dual A2A Adenosine Receptor Antagonists / Monoamine Oxidase B Inhibitors
by Yunierkis Pérez-Castillo, Maykel Cruz-Monteagudo, Aliuska Morales Helguera, M. Natalia D.S. Cordeiroc, Eduardo Tejerad, Cesar Paz-y-Minod, Aminael Sanchez-Rodriguez, Marta Teijeira Bautista, Evys Ancede-Gallardo, Fernando Cagide, Fernanda Borges (Central University of Las Villas, University of Porto)
publication · 6 years ago
Comparison of Combinatorial Clustering Methods on Pharmacological Data Sets Represented by Machine Learning-Selected Real Molecular Descriptors
by Oscar Miguel Rivera-Borroto, José Manuel García-de la Vega, Yovani Marrero- Ponce, Ricardo del Corazón Grau-Ábalo (Universidad Autónoma de Madrid, Central University of Las Villas)
publication · 6 years ago
Dunn's index for cluster tendency assessment of pharmacological datasets
by Oscar Miguel Rivera-Borroto, José Manuel García-de la Vega, Yovani Marrero- Ponce, Ricardo C. Grau-Ábalo, Mónica Rabassa-Gutiérrez (Universidad Autónoma de Madrid, Central University of Las Villas)
cluster analysis cluster tendency VAT techniques Dunn’s index pharmacological data sets clusters overlap classification accuracy
publication · 7 years ago
Novel similarity measures for the effective and efficient retrieval of chemoinformatic datasets
by Oscar Miguel Rivera-Borroto, Yoandy Hernández-Díaz, José Manuel García-de la Vega, Yovani Marrero- Ponce, Ricardo C. Grau-Ábalo (Universidad Autónoma de Madrid, Central University of Las Villas)