Alán Aspuru‐Guzik

A variational eigenvalue solver on a photonic quantum processor

Alberto Peruzzo, Jarrod R. McClean, Peter Shadbolt et al. · Nature Communications · 2014 · 4.6K citations · Full text

Natural Sciences, Chemistry, Physics +17

Advances in molecular quantum chemistry contained in the Q-Chem 4 program package

Yihan Shao, Zhengting Gan, Evgeny Epifanovsky et al. · Molecular Physics · 2014 · 3.1K citations

Natural Sciences, Chemistry, Physics +17

The theory of variational hybrid quantum-classical algorithms

Jarrod R. McClean, Jonathan Romero, Ryan Babbush et al. · New Journal of Physics · 2016 · 2.3K citations · Full text

Natural Sciences, Computer Science, Physics +15

Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules.

Rafael Gómez‐Bombarelli, Jennifer N. Wei, David Duvenaud et al. · Cambridge University Engineering Department Publications Database · 2018 · 2K citations · Full text

Pharmacy, Chemistry, Computational Chemistry +16

Noisy intermediate-scale quantum algorithms

Kishor Bharti, Alba Cervera-Lierta, Thi Ha Kyaw et al. · Reviews of Modern Physics · 2022 · 1.7K citations · Full text

Computing, Chemistry, Physics +15