Projects

Through collaborative partnerships, BioExcel is actively working on a number of major projects to address scientific problems and provide concrete solutions with impact to the wider biomolecular communities.

Current projects

• Antibody Design through Biomolecular Interactions Engineering
• High-Throughput Modelling of Interactomes
• Electronic Interaction Phenomena: Proton Dynamics and Fluorescent Proteins
• Rational Drug Design

Previous projects

• Rapid turnaround cancer analysis pipeline for high throughput sequencing data
• Free Energy Simulations of Biomolecular Complexes
• Multi-scale modeling of molecular basis for odor and taste
• Molecular Recognition
• Virtual Screening

Small-scale exploratory projects

• Standardization of BioExcel Building blocks
• biobb Web Server
• Workflow building blocks as KNIME nodes
• Druggable conformations of proteins from Enhanced-Sampling Molecular Dynamics
• One-stop shop workflow repository
• New interface for dynamic access to atom properties during GROMACS simulations

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