Robert Pollice

3.2k total citations · 4 hit papers
39 papers, 1.7k citations indexed

About

Robert Pollice is a scholar working on Materials Chemistry, Organic Chemistry and Atomic and Molecular Physics, and Optics. According to data from OpenAlex, Robert Pollice has authored 39 papers receiving a total of 1.7k indexed citations (citations by other indexed papers that have themselves been cited), including 14 papers in Materials Chemistry, 11 papers in Organic Chemistry and 10 papers in Atomic and Molecular Physics, and Optics. Recurrent topics in Robert Pollice's work include Machine Learning in Materials Science (12 papers), Advanced Chemical Physics Studies (9 papers) and Computational Drug Discovery Methods (7 papers). Robert Pollice is often cited by papers focused on Machine Learning in Materials Science (12 papers), Advanced Chemical Physics Studies (9 papers) and Computational Drug Discovery Methods (7 papers). Robert Pollice collaborates with scholars based in Canada, Switzerland and Netherlands. Robert Pollice's co-authors include Alán Aspuru‐Guzik, Gabriel dos Passos Gomes, AkshatKumar Nigam, Peter Chen, Cyrille Lavigne, Mario Krenn, Pascal Friederich, Cher Tian Ser, Zhenpeng Yao and Matteo Aldeghi and has published in prestigious journals such as Chemical Reviews, Journal of the American Chemical Society and Advanced Materials.

In The Last Decade

Robert Pollice

38 papers receiving 1.7k citations

Hit Papers

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What are hit papers?

Hit papers significantly outperform the citation benchmark for their cohort. A paper qualifies if it has ≥500 total citations, achieves ≥1.5× the top-1% citation threshold for papers in the same subfield and year (this is the minimum needed to enter the top 1%, not the average within it), or reaches the top citation threshold in at least one of its specific research topics.

Data-Driven Strategies for Accelerated Materials Design

2021 299 citations Robert Pollice, Gabriel dos Passos Gomes et al. profile →
A Comprehensive Discovery Platform for Organophosphorus Ligands for Catalysis

2022 192 citations Gabriel dos Passos Gomes, Pascal Friederich et al. Journal of the American Chemical Society profile →
On scientific understanding with artificial intelligence

2022 186 citations Mario Krenn, Robert Pollice et al. Nature Reviews Physics profile →
Autonomous Chemical Experiments: Challenges and Perspectives on Establishing a Self-Driving Lab

2022 154 citations Martin Seifrid, Robert Pollice et al. profile →

Author Peers

Peers are selected by citation overlap in the author's most active subfields. citations · hero ref

Author						Papers	Cites
Robert Pollice	791	368	335	332	218	39	1.7k
Edward O. Pyzer‐Knapp	947 1.2×	248 0.7×	354 1.1×	216 0.7×	229 1.1×	44	1.6k
Loı̈c M. Roch	1.3k 1.6×	490 1.3×	385 1.1×	258 0.8×	184 0.8×	36	2.2k
Álvaro Vázquez‐Mayagoitia	1.0k 1.3×	418 1.1×	326 1.0×	157 0.5×	185 0.8×	45	1.6k
Kjell Jorner	935 1.2×	370 1.0×	243 0.7×	919 2.8×	163 0.7×	44	1.8k
Chenru Duan	1.4k 1.8×	238 0.6×	567 1.7×	121 0.4×	245 1.1×	60	2.0k
Carlos Amador‐Bedolla	1.2k 1.6×	719 2.0×	261 0.8×	139 0.4×	118 0.5×	98	2.6k
Thijs Stuyver	780 1.0×	788 2.1×	223 0.7×	755 2.3×	252 1.2×	56	2.2k
Johannes Hachmann	941 1.2×	541 1.5×	341 1.0×	94 0.3×	140 0.6×	25	1.7k
Gabriel dos Passos Gomes	1.1k 1.4×	338 0.9×	425 1.3×	1.7k 5.0×	476 2.2×	61	3.4k
Yi‐Pei Li	743 0.9×	88 0.2×	330 1.0×	269 0.8×	158 0.7×	53	1.4k

Countries citing papers authored by Robert Pollice

Since Specialization

Citations

This map shows the geographic impact of Robert Pollice's research. It shows the number of citations coming from papers published by authors working in each country. You can also color the map by specialization and compare the number of citations received by Robert Pollice with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites Robert Pollice more than expected).

Fields of papers citing papers by Robert Pollice

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Robert Pollice. Nodes represent research fields, and links connect fields that are likely to share authors. Colored nodes show fields that tend to cite the papers produced by Robert Pollice. The network helps show where Robert Pollice may publish in the future.

Co-authorship network of co-authors of Robert Pollice

This figure shows the co-authorship network connecting the top 25 collaborators of Robert Pollice. A scholar is included among the top collaborators of Robert Pollice based on the total number of citations received by their joint publications. Widths of edges represent the number of papers authors have co-authored together. Node borders signify the number of papers an author published with Robert Pollice. Robert Pollice is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

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20 of 20 papers shown

Pollice, Robert, et al.. (2025). Developing large language models for quantum chemistry simulation input generation. Digital Discovery. 4(3). 762–775. 4 indexed citations

Pollice, Robert, et al.. (2025). Probing London Dispersion in Proton-Bound Onium Ions: Are Alkyl–Alkyl Steric Interactions Reliably Modeled?. Journal of the American Chemical Society. 147(5). 4308–4323. 2 indexed citations

Paenurk, Eno, et al.. (2025). Solvation Free Energies of Ion Dissociations in Dichloromethane: En Route to Accurate Computations. The Journal of Physical Chemistry B. 129(25). 6276–6288. 1 indexed citations

Hao, Han, et al.. (2025). Bulky Phosphine Ligands Promote Palladium-Catalyzed Protodeboronation. Journal of the American Chemical Society. 147(47). 43884–43901.

Blokhuis, Alex & Robert Pollice. (2024). Case Studies of Dimensionality in Chemical Data. European Journal of Organic Chemistry. 28(6). 2 indexed citations

Shafique, Muhammad, Milica Feldt, Luxuan Guo, et al.. (2024). The Fe-MAN Challenge: Ferrates–Microkinetic Assessment of Numerical Quantum Chemistry. The Journal of Physical Chemistry A. 128(23). 4663–4673. 1 indexed citations

Jorner, Kjell, Robert Pollice, Cyrille Lavigne, & Alán Aspuru‐Guzik. (2024). Ultrafast Computational Screening of Molecules with Inverted Singlet–Triplet Energy Gaps Using the Pariser–Parr–Pople Semiempirical Quantum Chemistry Method. The Journal of Physical Chemistry A. 128(12). 2445–2456. 31 indexed citations

Chen, Shuai & Robert Pollice. (2024). Predicting hydroformylation regioselectivity from literature data via machine learning. Chem Catalysis. 4(9). 101111–101111. 1 indexed citations

Nigam, AkshatKumar, Robert Pollice, Pascal Friederich, & Alán Aspuru‐Guzik. (2024). Artificial design of organic emitters via a genetic algorithm enhanced by a deep neural network. Chemical Science. 15(7). 2618–2639. 21 indexed citations

10.

Pollice, Robert, et al.. (2023). Recent advances in the self-referencing embedded strings (SELFIES) library. Digital Discovery. 2(4). 897–908. 12 indexed citations

11.

Chen, Xinrui, Sergey Bagnich, Robert Pollice, et al.. (2023). Unveiling the TADF Emitters with Apparent Negative Singlet‐Triplet Gaps: Implications for Exciton Harvesting and OLED Performance. Advanced Optical Materials. 12(6). 14 indexed citations

12.

Wu, Tony, Andrés Aguilar‐Granda, Kazuhiro Hotta, et al.. (2023). A Materials Acceleration Platform for Organic Laser Discovery (Adv. Mater. 6/2023). Advanced Materials. 35(6). 1 indexed citations

13.

Lavigne, Cyrille, Gabriel dos Passos Gomes, Robert Pollice, & Alán Aspuru‐Guzik. (2022). Guided discovery of chemical reaction pathways with imposed activation. Chemical Science. 13(46). 13857–13871. 8 indexed citations

14.

Nigam, AkshatKumar, Robert Pollice, & Alán Aspuru‐Guzik. (2022). Parallel tempered genetic algorithm guided by deep neural networks for inverse molecular design. Digital Discovery. 1(4). 390–404. 52 indexed citations

15.

Wu, Tony, Andrés Aguilar‐Granda, Kazuhiro Hotta, et al.. (2022). A Materials Acceleration Platform for Organic Laser Discovery. Advanced Materials. 35(6). e2207070–e2207070. 35 indexed citations

16.

Krenn, Mario, Robert Pollice, Si Yue Guo, et al.. (2022). On scientific understanding with artificial intelligence. Nature Reviews Physics. 4(12). 761–769. 186 indexed citations breakdown →

17.

Pollice, Robert, Pascal Friederich, Cyrille Lavigne, Gabriel dos Passos Gomes, & Alán Aspuru‐Guzik. (2021). Organic molecules with inverted gaps between first excited singlet and triplet states and appreciable fluorescence rates. Matter. 4(5). 1654–1682. 126 indexed citations

18.

Nigam, AkshatKumar, Robert Pollice, Mario Krenn, Gabriel dos Passos Gomes, & Alán Aspuru‐Guzik. (2021). Beyond generative models: superfast traversal, optimization, novelty, exploration and discovery (STONED) algorithm for molecules using SELFIES. Chemical Science. 12(20). 7079–7090. 100 indexed citations

19.

Schönbauer, David, et al.. (2019). Investigations of the generality of quaternary ammonium salts as alkylating agents in direct C–H alkylation reactions: solid alternatives for gaseous olefins. Organic & Biomolecular Chemistry. 17(16). 4024–4030. 7 indexed citations

20.

Pollice, Robert, et al.. (2018). Rhodium-catalyzed direct alkylation of benzylic amines using alkyl bromides. Monatshefte für Chemie - Chemical Monthly. 150(1). 127–138. 2 indexed citations

Rankless uses publication and citation data sourced from OpenAlex, an open and comprehensive bibliographic database. While OpenAlex provides broad and valuable coverage of the global research landscape, it—like all bibliographic datasets—has inherent limitations. These include incomplete records, variations in author disambiguation, differences in journal indexing, and delays in data updates. As a result, some metrics and network relationships displayed in Rankless may not fully capture the entirety of a scholar's output or impact.

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