Sergio Pablo-García

6PUBLICATIONS
24CO-AUTHORS
Structure and dynamics of materialsData structures and algorithmsCatalysis and mechanisms of reactionsSemi- and unsupervised learningDeep learning
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Publications (6)

|May 12, 2026
Adsorption Hysteresis Under Control: Tuning Host-Guest Interactions via a Genetic Algorithm.

|Mar 23, 2026
Database utility for cyclovoltammetry knowledge (DUCK): unified platform for electrochemical data.

Diego Garay-Ruiz, Sergio Pablo-García, Han Hao

|Nov 17, 2025
Bulky Phosphine Ligands Promote Palladium-Catalyzed Protodeboronation.

Cher Tian Ser, Han Hao, Sergio Pablo-García

|Oct 14, 2024
Spiers Memorial Lecture: How to do impactful research in artificial intelligence for chemistry and materials science.

Austin H Cheng, Cher Tian Ser, Marta Skreta

|Oct 14, 2024
Automated electrosynthesis reaction mining with multimodal large language models (MLLMs).

Shi Xuan Leong, Sergio Pablo-García, Zijian Zhang

|Jan 04, 2024
Fast evaluation of the adsorption energy of organic molecules on metals via graph neural networks.

Sergio Pablo-García, Santiago Morandi, Rodrigo A Vargas-Hernández

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Frequent Collaborators

5 joint publications

Alán Aspuru-Guzik

2 joint publications

Shi Xuan Leong

2 joint publications

Cher Tian Ser

1 joint publications

Santiago Morandi