Probabilistic Approach for Virtual Screening Based on Multiple Pharmacophores

Pharmacophore modeling is usually considered as a special type of virtual screening without probabilistic nature. Correspondence of at least one conformation of a molecule to pharmacophore is considered as evidence of its bioactivity. We show that pharmacophores can be treated as one-class machine l...

Descripción completa

Detalles Bibliográficos
Autores principales: Madzhidov, Timur I., Rakhimbekova, Assima, Kutlushuna, Alina, Polishchuk, Pavel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Communication
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7024325/
https://www.ncbi.nlm.nih.gov/pubmed/31963467
http://dx.doi.org/10.3390/molecules25020385

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7024325/
https://www.ncbi.nlm.nih.gov/pubmed/31963467
http://dx.doi.org/10.3390/molecules25020385

Ejemplares similares