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/Project: We are building an optimisation-driven framework that (i) makes AI agents reliably operate advanced scientific software (e.g., DFT, Wannierisation, and quantum-transport codes) and (ii) uses
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dynamics of the Rev Recognition Element (RRE) in the HIV-1 RNA and the discovery of antiviral small-molecule agents blocking the complex between this motif and the Rev protein. A consortium of structural
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