Area of research
Molecular Biology · Computational Theory and Mathematics
Research interest
Research interests include Chemical Synthesis and Analysis, Computational Drug Discovery Methods, Antimicrobial Peptides and Activities, and Dendrimers and Hyperbranched Polymers.
Structure, sequon recognition and mechanism of tryptophan C-mannosyltransferase
Medium-Chain Lipid Conjugation Facilitates Cell-Permeability and Bioactivity
Mapping the space of chemical reactions using attention-based neural networks
One molecular fingerprint to rule them all: drugs, biomolecules, and the metabolome
AiZynthFinder: a fast, robust and flexible open-source software for retrosynthetic planning
Visualization of very large high-dimensional data sets as minimum spanning trees
Structure and mechanism of the ER-based glucosyltransferase ALG6
Randomized SMILES strings improve the quality of molecular generative models
Mapping the Azolog Space Enables the Optical Control of New Biological Targets
The Chemical Space Project
Structural Insight into Multivalent Galactoside Binding to <i>Pseudomonas aeruginosa</i> Lectin LecA
Enumeration of 166 Billion Organic Small Molecules in the Chemical Universe Database GDB-17
Multivalent glycoconjugates as anti-pathogenic agents
Exploring Chemical Space for Drug Discovery Using the Chemical Universe Database