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Improvements in accuracy of quantum algorithms for chemical systems, without additional costJulia RiceMario Mottaet al.2022ACS Spring 2022
Accelerating materials discovery for carbon dioxide capture, conversion and storageMathias Steiner2022ACS Spring 2022
Early prediction of metastasis in women with locally advanced breast cancerSimona Rabinovici-CohenTal Tlustyet al.2022SPIE Medical Imaging 2022
Model for simulations of the CnEm nonionic surfactant family derived from recent experimental resultsWilliam SwopeMichael Johnstonet al.2022ACS Spring 2022
Quantum algorithms for quantum dynamics: A performance study on the spin-boson modelAlexander MiessenPauline Jeanne Ollitraultet al.2022ACS Spring 2022
Proposal for using molecular spin qudits as quantum simulators of light–matter interactionsFrancesco TacchinoAlessandro Chiesaet al.2022ACS Spring 2022
Accurate multi-endpoint molecular toxicity predictions in humans with contrastive explanationsBhanushee SharmaVijil Chenthamarakshanet al.2022ACS Spring 2022
Development of polymer information systems to support accelerated materials development via AI-enabled automated experimentationNathaniel ParkMatteo Manicaet al.2022ACS Spring 2022