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)

|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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