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Practical matters How to find us R. (Robert) Pollice, Dr

R. (Robert) Pollice, Dr

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Faculty of Science and Engineering

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r.pollice rug.nl

Homepage ORCID Research Portal

Publications

A Comprehensive Discovery Platform for Organophosphorus Ligands for Catalysis

Gensch, T. , Dos Passos Gomes, G. , Friederich, P. , Peters, E. , Gaudin, T. , Pollice, R. , Jorner, K. , Nigam, A. , Lindner-D'Addario, M. , Sigman, M. S. & Aspuru-Guzik, A. , 26-Jan-2022 , In: Journal of the American Chemical Society. 144 , 3 , p. 1205-1217 13 p.

Research output: Contribution to journal › Article › Academic › peer-review

Autonomous Chemical Experiments: Challenges and Perspectives on Establishing a Self-Driving Lab

Seifrid, M. , Pollice, R. , Aguilar-Granda, A. , Chan, Z. M. , Hotta, K. , Ser, C. T. , Vestfrid, J. , Wu, T. C. & Aspuru-Guzik, A. , 6-Sept-2022 , In: Accounts of Chemical Research. 55 , 17 , p. 2454–2466 13 p.

Research output: Contribution to journal › Article › Academic › peer-review

Parallel tempered genetic algorithm guided by deep neural networks for inverse molecular design

Nigam, A. , Pollice, R. & Aspuru-Guzik, A. , 2022 , In: Digital Discovery. 2022 , 1 , p. 390-404 15 p.

Research output: Contribution to journal › Article › Academic › peer-review

Assigning confidence to molecular property prediction

Nigam, A. , Pollice, R. , Hurley, M. F. D. , Hickman, R. J. , Aldeghi, M. , Yoshikawa, N. , Chithrananda, S. , Voelz, V. A. & Aspuru-Guzik, A. , Jun-2021 , In: Expert Opinion on Drug Discovery. 16 , 9 , p. 1009-1023 15 p.

Research output: Contribution to journal › Article › Academic › peer-review

Beyond generative models: superfast traversal, optimization, novelty, exploration and discovery (STONED) algorithm for molecules using SELFIES

Nigam, A. , Pollice, R. , Krenn, M. , Gomes, G. D. P. & Aspuru-Guzik, A. , 2021 , In: Chemical Science. 12 , 20 , p. 7079-7090 12 p.

Research output: Contribution to journal › Article › Academic › peer-review

Data-Driven Strategies for Accelerated Materials Design

Pollice, R. , Gomes, G. D. P. , Aldeghi, M. , Hickman, R. J. , Krenn, M. , Lavigne, C. , Lindner-D’Addario, M. , Nigam, A. , Ser, C. T. , Yao, Z. & Aspuru-Guzik, A. , 16-Feb-2021 , In: Accounts of Chemical Research. 54 , 4 , p. 849–860 12 p.

Research output: Contribution to journal › Article › Academic › peer-review

Navigating through the Maze of Homogeneous Catalyst Design with Machine Learning

Gomes, G. D. P. , Pollice, R. & Aspuru-Guzik, A. , Feb-2021 , In: Trends in Chemistry. 3 , 2 , p. 96-110 15 p.

Research output: Contribution to journal › Article › Academic › peer-review

Organic molecules with inverted gaps between first excited singlet and triplet states and appreciable fluorescence rates

Pollice, R. , Friederich, P. , Lavigne, C. , Gomes, G. D. P. & Aspuru-Guzik, A. , May-2021 , In: Matter. 4 , 5 , p. 1654-1682 29 p.

Research output: Contribution to journal › Article › Academic › peer-review

A Universal Quantitative Descriptor of the Dispersion Interaction Potential

Pollice, R. & Chen, P. , 15-Jul-2019 , In: Angewandte Chemie International Edition. 58 , 29 , p. 9758-9769 12 p.

Research output: Contribution to journal › Article › Academic › peer-review

Compensation of London Dispersion in the Gas Phase and in Aprotic Solvents

Pollice, R. , Fleckenstein, F. , Shenderovich, I. & Chen, P. , 1-Oct-2019 , In: Angewandte Chemie International Edition. 58 , 40 , p. 14281-1428 8 p.

Research output: Contribution to journal › Article › Academic › peer-review

All (18) publications

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