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of Group/Project: We are building an optimisation-driven framework that makes AI models reliably operate advanced scientific software (e.g., DFT, Wannierisation, and quantum-transport codes) and (ii) uses
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the 'drug' or the 'transport system'. Such components include DNA, RNA, viruses, stem cells, radionuclides, liposomes, graphene, 2D-heterostructures, carbon nanotubes and other nanomaterials (quantum dots
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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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