The challenge of reproducing with calculations raw experimental kinetic data for an organic reaction R Pérez-Soto, M Besora, F Maseras Organic letters 22 (8), 2873-2877, 2020 | 30 | 2020 |
AQME: Automated quantum mechanical environments for researchers and educators JV Alegre‐Requena, S Sowndarya SV, R Pérez‐Soto, TM Alturaifi, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 13 (5), e1663, 2023 | 22 | 2023 |
Comprehensive mechanistic scenario for the Cu-mediated asymmetric propargylic sulfonylation forging tertiary carbon stereocenters A Garcia-Roca, R Pérez-Soto, G Stoica, J Benet-Buchholz, F Maseras, ... Journal of the American Chemical Society 145 (11), 6442-6452, 2023 | 22 | 2023 |
Introducing the catalytic amination of silanes via nitrene insertion AM Rodríguez, J Pérez-Ruíz, F Molina, A Poveda, R Pérez-Soto, ... Journal of the American Chemical Society 144 (23), 10608-10614, 2022 | 12 | 2022 |
Out-of-oblivion cage molecules and their porous crystalline phases IG Garcia, M Bernabei, RP Soto, M Haranczyk Crystal Growth & Design 17 (11), 5614-5619, 2017 | 12 | 2017 |
Photodissociation of acryloyl chloride at 193 nm: interpretation of the product energy distributions, and new elimination pathways R Pérez-Soto, SA Vázquez, E Martínez-Núñez Physical Chemistry Chemical Physics 18 (6), 5019-5026, 2016 | 12 | 2016 |
In silico design and assembly of cage molecules into porous molecular materials M Bernabei, R Pérez-Soto, IG García, M Haranczyk Molecular Systems Design & Engineering 3 (6), 942-950, 2018 | 11 | 2018 |
Computational discovery of a large-imine-cage-based porous molecular material and its application in water desalination M Bernabei, RP Soto, IG García, M Haranczyk Molecular Systems Design & Engineering 4 (4), 912-920, 2019 | 6 | 2019 |
Towards stable porous crystalline phases of molecular belts M Bernabei, R Pérez-Soto, IG García, M Haranczyk CrystEngComm 19 (46), 6932-6935, 2017 | 2 | 2017 |
The Sooting Behavior of Lactones as Sustainable Fuels Z Xiang, M Acikel, C Hansen, GU Jeong, S Kim, C McEnally, ... | | 2024 |
rNets: a standalone package to visualize reaction networks SP García, R Pérez-Soto, A Sabadell-Rendón, D Garay-Ruiz, ... Royal Society of Chemistry, 2024 | | 2024 |
Sooting tendencies: Combustion science for designing sustainable fuels with improved properties LD Pfefferle, S Kim, S Kumar, CS McEnally, R Pérez-Soto, Z Xiang, ... Proceedings of the Combustion Institute 40 (1-4), 105750, 2024 | | 2024 |
rNets: An standalone package to visualize reaction networks. S Pablo-García, R Pérez-Soto, A Sabadell-Rendon, D Garay-Ruiz, ... Digital Discovery, 2024 | | 2024 |
Cover Image, Volume 13, Issue 5 JV Alegre‐Requena, SS SV, R Pérez‐Soto, TM Alturaifi, RS Paton Wiley Interdisciplinary Reviews: Computational Molecular Science 5 (13), n/a-n/a, 2023 | | 2023 |
AQME paper examples [Dataset] JV Alegre-Requena, S Sowndarya SV, R Pérez-Soto, TM Alturaifi, ... Figshare, 2023 | | 2023 |
Modeling the Self-Assembly of Cage Molecules RP Soto Universitat Rovira i Virgili, 2022 | | 2022 |
Introducing the Catalytic Amination of Silanes via Nitrene Insertion A Moreno Rodríguez, J Pérez Ruíz, F Molina González, A Poveda, ... American Chemical Society, 0 | | |