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F. Calcagno

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Open access Aug 2025

The quantum ensemble variational optimization algorithm: Applications to molecular inverse design.

The numerical simulations demonstrate the potential of QEVO to design drug-like molecules with anticancer properties, operating in combinatorial spaces composed of up to up to [Formula: see text] solutions, while employing a shallow quantum circuit that requires only a modest number of qubits.

F. Calcagno, Delmar G. A. Cabral, Ivan Rivalta et al. · 0 citations

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