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Sergio Pablo‐García

acceleration consortium

16H-index
51Paper Count
1.1KCitation Count
Published Papers 19
Publication Date
Adsorption Hysteresis Under Control: Tuning Host–Guest Interactions via a Genetic Algorithm
err2026-05-12
err0
errOAAI
errJesse L. Prelesnik; Filip Formalik; Samantha Corapi; Sergio Pablo-García; Alán Aspuru-Guzik; Randall Q. Snurr; J. Ilja Siepmann
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Database utility for cyclovoltammetry knowledge (DUCK): unified platform for electrochemical data
err2026-03-28
err0
errOAAI
errDiego Garay-Ruiz; Sergio Pablo-García; Han Hao; Marisol Martín-González
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Bulky Phosphine Ligands Promote Palladium-Catalyzed Protodeboronation
err2025-11-17
err0
PREAI
errCher Tian Ser; Han Hao; Sergio Pablo-García; Kjell Jorner; Shangyu Li; Robert Pollice; Alán Aspuru-Guzik
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MERMaid: Universal multimodal mining of chemical reactions from PDFs using vision-language models
errMatter
IF17.5
err2025-07-25
err0
errOAAI
errShi Xuan Leong; Sergio Pablo-García; Brandon Wong; Alán Aspuru-Guzik
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Developing machine learning for heterogeneous catalysis with experimental and computational data
err2025-07-18
err0
PREAI
errCarlota Bozal-Ginesta; Sergio Pablo-García; Changhyeok Choi; Albert Tarancón; Alán Aspuru-Guzik
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Spiers Memorial Lecture: How to do impactful research in artificial intelligence for chemistry and materials science
err2025-01-01
err0
errOAAI
errCheng, Austin H.; Ser, Cher Tian; Skreta, Marta; Guzman-Cordero, Andres; Thiede, Luca; Burger, Andreas; Aldossary, Abdulrahman; Leong, Shi Xuan; Pablo-Garcia, Sergio; Strieth-Kalthoff, Felix; Aspuru-Guzik, Alan
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Does one need to polish electrodes in an eight pattern? Automation provides the answer
err2025-01-01
err0
errOAAI
errYoshikawa, Naruki; Akkoc, Gun Deniz; Pablo-Garcia, Sergio; Cao, Yang; Hao, Han; Aspuru-Guzik, Alan
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Performance Prediction of High-Entropy Perovskites La0.8Sr0.2MnxCoyFezO3 with Automated High-Throughput Characterization of Combinatorial Libraries and Machine Learning
err2024-11-05
err0
errOAAI
errBozal-Ginesta, Carlota; Sirvent, Juande; Cordaro, Giulio; Fearn, Sarah; Pablo-Garcia, Sergio; Chiabrera, Francesco; Choi, Changhyeok; Laa, Lisa; Nunez, Marc; Cavallaro, Andrea; Buzi, Fjorelo; Aguadero, Ainara; Dezanneau, Guilhem; Kilner, John; Morata, Alex; Baiutti, Federico; Aspuru-Guzik, Alan; Tarancon, Albert
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ChemOS 2.0: An orchestration architecture for chemical self-driving laboratories
errMATTER
IF17.5
err2024-09-01
err8
PREAI
errSim, Malcolm; Vakili, Mohammad Ghazi; Strieth-Kalthoff, Felix; Hao, Han; Hickman, Riley J.; Miret, Santiago; Pablo-Garcia, Sergio; Aspuru-Guzik, Alan
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In Silico Chemical Experiments in the Age of AI: From Quantum Chemistry to Machine Learning and Back
err2024-05-25
err6
PREAI
errAldossary, Abdulrahman; Campos-Gonzalez-Angulo, Jorge Arturo; Pablo-Garcia, Sergio; Leong, Shi Xuan; Rajaonson, Ella Miray; Thiede, Luca; Tom, Gary; Wang, Andrew; Avagliano, Davide; Aspuru-Guzik, Alan
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rNets: a standalone package to visualize reaction networks
err2024-01-01
err3
errOAAI
errPablo-Garcia, Sergio; Perez-Soto, Raul; Sabadell-Rendon, Albert; Garay-Ruiz, Diego; Nosylevskyi, Vladyslav; Lopez, Nuria
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Atlas: a brain for self-driving laboratories
err2024-01-01
err0
errOAAI
errHickman, Riley J.; Sim, Malcolm; Pablo-Garcia, Sergio; Tom, Gary; Woolhouse, Ivan; Hao, Han; Bao, Zeqing; Bannigan, Pauric; Allen, Christine; Aldeghi, Matteo; Aspuru-Guzik, Alan
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Automated electrosynthesis reaction mining with multimodal large language models (MLLMs)
err2024-01-01
err1
errOAAI
errLeong, Shi Xuan; Pablo-Garcia, Sergio; Zhang, Zijian; Aspuru-Guzik, Alan
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Fast evaluation of the adsorption energy of organic molecules on metals via graph neural networks
err2023-05-01
err30
errOAAI
errPablo-Garcia, Sergio; Morandi, Santiago; Vargas-Hernandez, Rodrigo A.; Jorner, Kjell; Ivkovic, Zarko; Lopez, Nuria; Aspuru-Guzik, Alan
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Generalizing Performance Equations in Heterogeneous Catalysis from Hybrid Data and Statistical Learning
err2022-01-11
err12
errOAAI
errPablo-Garcia, Sergio; Sabadell-Rendon, Albert; Saadun, Ali J.; Morandi, Santiago; Perez-Ramirez, Javier; Lopez, Nuria
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Mechanistic routes toward C<sub>3</sub> products in copper-catalysed CO<sub>2</sub> electroreduction
err2022-01-01
err49
errOAAI
errPablo-Garcia, Sergio; Veenstra, Florentine L. P.; Ting, Louisa Rui Lin; Garcia-Muelas, Rodrigo; Dattila, Federico; Martin, Antonio J.; Yeo, Boon Siang; Perez-Ramirez, Javier; Lopez, Nuria
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Nuclearity and Host Effects of Carbon-Supported Platinum Catalysts for Dibromomethane Hydrodebromination
errSMALL
IF12.1
err2021-01-19
err10
PREAI
errSaadun, Ali J.; Kaiser, Selina K.; Ruiz-Ferrando, Andrea; Pablo-Garcia, Sergio; Buechele, Simon; Fako, Edvin; Lopez, Nuria; Perez-Ramirez, Javier
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Performance of Metal-Catalyzed Hydrodebromination of Dibromomethane Analyzed by Descriptors Derived from Statistical Learning
err2020-04-10
err21
PREAI
errSaadun, A. J.; Pablo-Garcia, S.; Paunovic, V; Li, Q.; Sabadell-Rendon, A.; Kleemann, K.; Krumeich, F.; Lopez, N.; Perez-Ramirez, J.
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