We are part of the H2020-MSCA-ITN team INTERfaces!

We are part of the team being awarded the H2020 Marie Skłodowska-Curie Actions (MSCA) Innovative Training Networks (ITN) – European Industrial Doctorates (EID) with the project “INTERfaces – Heterogeneous biocatalysis reaction cascades training network” INTERfaces combines material science and protein engineering to design tailored enzymes and (bio-based) materials that will complement each other to obtain […]

In press on ACS Med. Chem. Lett.!

We have identified a strong diazepane based σR ligand with high affinity, low cytotoxicity, and excellent antioxidant profile. For further details, read our paper here: D. Zampieri, S. Fortuna, A. Calabretti, M. Romano, R. Menegazzi, D. Schepmann, B. Wünsch, M.G. Mamolo Synthesis, Cytotoxicity Evaluation and Computational Insights of Novel 1,4-Diazepane-Based Sigma Ligands ACS Med. Chem. […]

Just accepted in Chemical Communications!!!

Our paper “A consensus protocol for the in silico optimisation of antibody fragments” has just been accepted for publications, marking the first milestone of our AIRC project “Computational design of customised nanobodies for oncology applications: prognostic candidates for HER2 as first case”. In this paper we present BINDesignER: our in silico mutagenetic protocol for the […]

We have been awarded a “ARDF’s Annual Open grant” from the Alternatives Research & Development Foundation (ARDF)

Our commitment in the development of new computational protocols that can compete and, in time, eliminate the demand for in vivo procedures for antibody discovery and maturation has been prized with a 40,000$ grant with the project “In silico design of customised high-affinity antibody fragments for biomarker detection” from the Alternatives Research & Development Foundation […]

JPCC COVER!

Our paper Influence of Molecule-Surface and Molecule-Molecule Interactions on Two-Dimensional Patterns formed by Functionalised Aromatic Molecules is featured on the cover of the Journal of Physical Chemistry C. The Image was created and rendered with POV-Ray. Actually POV-Ray feels a lot as a scripting language as it is quite easy to code, but it is also […]