Quantification and characterization of the relationship between intra- and inter-tumour gene expression heterogeneity across a large pan-cancer pediatric cohort.
Coming soon...

We are building a family of tools to fix the RNA expression profiles degradation caused by formalin-fixation paraffin-embedding and increase its compatibility with data snap-frozen samples.
Coming soon...

We are investigating transcriptional differences between benign and malignant thyroid neoplasms to improve on current gene expression-based classifiers
Coming soon...

We improved on the search for allosteric binding sites in target proteins of pharmaceutical interest in molecular simulations by combining fragment probes with a Hamiltonian replica exchange method to enhance the sampling of hydrophobic cavities.

We investigated the binding properties of ligand-gated ion channels with molecular simulations and enhanced sampling methods. The limits of binding interactions were tested through mutagenesis models.

Enhanced sampling simulations allowed us to obtain a complete free energy conformational map for a simple aspartic acid molecule under different environmental conditions.