Chemical reaction network knowledge graphs: the OntoRXN ontology.
PMID:35637523
The AOP-DB RDF: Applying FAIR Principles to the Semantic Integration of AOP Data Using the Research Description Framework.
PMID:35295213
From Platform to Knowledge Graph: Evolution of Laboratory Automation.
PMID:35252980
Data-Centric Architecture for Self-Driving Laboratories with Autonomous Discovery of New Nanomaterials.
PMID:35009962
FORUM: Building a Knowledge Graph from public databases and scientific literature to extract associations between chemicals and diseases.
PMID:34478489
IDSM ChemWebRDF: SPARQLing small-molecule datasets.
PMID:33980298
Untargeted In Silico Compound Classification-A Novel Metabolomics Method to Assess the Chemodiversity in Bryophytes.
PMID:33806786
An empirical meta-analysis of the life sciences linked open data on the web.
PMID:33479214
Toward Automated Inventory Modeling in Life Cycle Assessment: The Utility of Semantic Data Modeling to Predict Real-World Chemical Production.
PMID:32632354
Meta-QSAR: a large-scale application of meta-learning to drug design and discovery.
PMID:31997851
Chemical Diversity and Classification of Secondary Metabolites in Nine Bryophyte Species.
PMID:31614655
DNAmod: the DNA modification database.
PMID:31016417
Too many tags spoil the metadata: investigating the knowledge management of scientific research with semantic web technologies.
PMID:30900066
Integration among databases and data sets to support productive nanotechnology: Challenges and recommendations.
PMID:30246165
Knowledge Discovery from Biomedical Ontologies in Cross Domains.
PMID:27548262
Development of an informatics infrastructure for data exchange of biomolecular simulations: Architecture, data models and ontology.
PMID:26387907
PubChemRDF: towards the semantic annotation of PubChem compound and substance databases.
PMID:26175801
eNanoMapper: harnessing ontologies to enable data integration for nanomaterial risk assessment.
PMID:25815161
Machines first, humans second: on the importance of algorithmic interpretation of open chemistry data.
PMID:25798198
QSAR DataBank - an approach for the digital organization and archiving of QSAR model information.
PMID:24910716
Usage and applications of Semantic Web techniques and technologies to support chemistry research.
PMID:24855494
Cheminformatics and the Semantic Web: adding value with linked data and enhanced provenance.
PMID:24432050
The ChEMBL bioactivity database: an update.
PMID:24214965
A DNA-based semantic fusion model for remote sensing data.
PMID:24116207
Ontology-Based Querying with Bio2RDF's Linked Open Data.
PMID:23735196
The ChEMBL database as linked open data.
PMID:23657106
Applications of the InChI in cheminformatics with the CDK and Bioclipse.
PMID:23497723
Automated compound classification using a chemical ontology.
PMID:23273256
Fast rule-based bioactivity prediction using associative classification mining.
PMID:23176548
A survey of quantitative descriptions of molecular structure.
PMID:23110530
The Units Ontology: a tool for integrating units of measurement in science.
PMID:23060432
Why open drug discovery needs four simple rules for licensing data and models.
PMID:23028298
OpenTox predictive toxicology framework: toxicological ontology and semantic media wiki-based OpenToxipedia.
PMID:22541598