The pmx Webserver: a Powerful Tool for Free Energy Calculations
BioExcel supports the development of pmx, a tool for researchers utilising free energy calculations. Free energy calculations are extremely common in life sciences
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Success stories
Environment meets genetics: New lessons for Parkinson’s disease
FZ Jülich, a BioExcel partner, is using CPMD, a leading QM/MM software package, to understand more about how Parkinson’s disease develops. Parkinson’s disease
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HADDOCK shows how bacteria steal iron from the plants they infect
Researchers using the HADDOCK modelling software, a key part of the BioExcel community, have discovered how bacteria steal iron from plants, helping the
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