Knowledge Extraction from Nanosafety DataRobert RalloUniversitat Rovira i Virgili, Catalunya

Nanosafety Knowledge Infrastructure (NSKI)Brussels, January 26, 2016

Nanosafety (big) data

Structured Semi-Structured UnstructuredManagement & Processing complexity

Knowledge extraction

Analysis&

DataMining

DataManagement

Modeling

Use

Data

Information

Knowledge

Nano-(Q)SAR, Fate & Transport, …

Nanodescriptors

Risk Assessment, Safe-by-design, …

Auth

entic

atio

n&

Acce

ss

Con

trol

KI needs

Academia

IndustryRegulators

General public

NANOSAFETY DATA WAREHOUSE(structured, semi-structured, unstructured)

Data Curation and QA/QC protocols

LIMS Real-timemonitoring

Data providers

DATA PROCESSING SERVICES

Literaturedata

NANOSAFETYONTOLOGY

DATASHARING

STANDARDS

Analytics(data mining, quantum chemistry, molecular modeling, …)

Modeling(machine learning, statistical models, mechanistic models, …)

Execution(Descriptor calculation, toxicity prediction, …)

Acknowledgement

• EU FP7 MODERN, Contract No. 309314

• 2014SGR 1352, Generalitat de Catalunya