Quantum algorithm for alchemical optimization in material design
نویسندگان
چکیده
‘Alchemical’ quantum algorithm for the simultaneous optimisation of chemical composition and electronic structure material design. By exploiting mechanical principles this approach will boost drug discovery in near future.
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ژورنال
عنوان ژورنال: Chemical Science
سال: 2021
ISSN: ['2041-6520', '2041-6539']
DOI: https://doi.org/10.1039/d0sc05718e