Selected papers

Interoperable chemical structure search service
Journal of Cheminformatics 11 (28): 45 (2019)
Sachem: a chemical cartridge for high-performance substructure search
Journal of Cheminformatics 10 (23): 0-0 (2018)
Amino Acid Interaction (INTAA) web server
Nucleic Acids Research 45 (W1): W388-W392 (2017)

Latest publications

The IDSM mass spectrometry extension: searching mass spectra using SPARQL
Bioinformatics 2024: Early View
What are the minimal folding seeds in proteins? Experimental and theoretical assessment of secondary structure propensities of small peptide fragments
Chemical Science 15 (2): 594-608 (2024)
A comparison of approaches to accessing existing biological and chemical relational databases via SPARQL
Journal of Cheminformatics 15: 61 (2023)
Fully automated virtual screening pipeline of FDA-approved drugs using Caver Web
Computational and Structural Biotechnology Journal 20: 6512–6518 (2022)