EXSCALATE

EXaSCale smArt pLatform Against paThogEns

First computational platform devoted to addressing the need to promptly respond to  pandemic crisis

Platform
Projects
Partners & Networks

Platform

Ligen

The exa-scale ready tool: LiGen™

LiGen™ (Ligand Generator) is the de novo structure based virtual screening software co-designed with the italian super computer center CINECA, engineered to run natively on supercomputers architectures as a key competitive advantage versus other tools. ...READ MORE 

database

Tangible Chemical Space

Dompé has generated an already available tangible virtual chemical space of 500 Billions of compounds, and will be able to obtain trillions of compounds before the end of 2020. The EXSCALATE platform exploits this huge compound library in exascale HPC virtual screening applications. ...READ MORE 

HPC

HPC Performance

Dompé developed an Ultra High Performance Virtual Screening Platform based on LiGenTM and a virtual library of trillion of compounds. 1.2 billion molecules against 1 biological target using on more than 900K hardware threads on the MARCONI Tier-0 system at CINECA. ...READ MORE 

Projects

Antarex4Zika

Antarex4Zika

To demonstrate the benefits of code optimization and scalability, Dompé selected the Zika pandemic crisis to support and promote the identification of novel drugs able to address the unmet medical need in terms of effective therapies. ...READ MORE 

JBG

Upcoming

2019

JBG

Upcoming

2021

Address

Via Pietro Castellino, 111
80131 Napoli, Italy

Contact us

Email: support@exscalate.eu               
Phone: +39 (0) 81 613 2698