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Daniel Platero-Rochart

5PUBLICATIONS

8CO-AUTHORS

Cheminformatics and quantitative structure-activity relationshipsProcess control and simulationBioinformatic methods developmentData structures and algorithms

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Publications (5)

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|Jan 26, 2026

Study on the Binding of Five Plant-Derived Secondary Metabolites to G‑Quadruplexes.

Lucie Vrtalová, Michaela Dobrovolná, Daniel Platero-Rochart

|Jul 21, 2023

Prediction of Enzyme Catalysis by Computing Reaction Energy Barriers via Steered QM/MM Molecular Dynamics Simulations and Machine Learning.

Daniel Platero-Rochart, Tatyana Krivobokova, Michael Gastegger

|Oct 07, 2022

MDSCAN: RMSD-based HDBSCAN clustering of long molecular dynamics.

Roy González-Alemán, Daniel Platero-Rochart, Alejandro Rodríguez-Serradet

|Jan 12, 2022

RCDPeaks: memory-efficient density peaks clustering of long molecular dynamics.

Daniel Platero-Rochart, Roy González-Alemán, Erix W Hernández-Rodríguez

|Aug 16, 2021

BitQT: a graph-based approach to the quality threshold clustering of molecular dynamics.

Roy González-Alemán, Daniel Platero-Rochart, David Hernández-Castillo

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Frequent Collaborators

3 joint publications

Roy González-Alemán

3 joint publications

Julio Caballero

2 joint publications

Pedro A Sánchez-Murcia

1 joint publications

David Hernández-Castillo

1 joint publications

Erix W Hernández-Rodríguez

1 joint publications

Fabrice Leclerc

1 joint publications

Luis Montero-Cabrera

1 joint publications

Václav Brázda

Frequent Collaborators

3 joint publications

Roy González-Alemán

3 joint publications

Julio Caballero

2 joint publications

Pedro A Sánchez-Murcia

1 joint publications

David Hernández-Castillo

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