BRUSELAS
Balanced Rapid Unrestricted Server for Extensive Ligand-Aimed Screening
Ligand-based virtual screening combining shape and pharmacophore.
About
BRUSELAS is a web server for ligand-based virtual screening (LBVS) experiments. Given a query molecule, it screens large compound libraries and returns ranked candidates that combine shape and pharmacophore similarity.
Its modular architecture allows new compounds and algorithms to be added easily, and a wide set of parameters lets users customise experiments for different application domains.
Key features
Modular & extensible
Components can be overwritten and new algorithms integrated.
Scalable to large libraries
Designed for screening of hundreds of thousands of compounds.
Email report
Detailed prediction report delivered by email — no registration required.
Access
Web server
Open the BRUSELAS web server
Free web access · commercial licence available on request
https://bio-hpc.ucam.edu/Bruselas/ →Cite this tool
BRUSELAS: HPC Generic and Customizable Software Architecture for 3D Ligand-Based Virtual Screening of Large Molecular Databases