Erandika Karunaratne

3PUBLICATIONS
13CO-AUTHORS
Computational chemistryMetabolomic chemistryCrystallography
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Publications (3)

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|Jan 29, 2024
Prediction of stability constants of metal-ligand complexes by machine learning for the design of ligands with optimal metal ion selectivity.

Federico Zahariev, Tamalika Ash, Erandika Karunaratne

|Aug 04, 2023
Combining Experimental with Computational Infrared and Mass Spectra for High-Throughput Nontargeted Chemical Structure Identification.

Erandika Karunaratne, Dennis W Hill, Kai Dührkop

|Jul 21, 2021
High-Throughput Non-targeted Chemical Structure Identification Using Gas-Phase Infrared Spectra.

Erandika Karunaratne, Dennis W Hill, Philipp Pracht

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Frequent Collaborators

2 joint publications

David F Grant

1 joint publications

Philipp Pracht

1 joint publications

José A Gascón

1 joint publications

Stefan Grimme

1 joint publications

Dennis W Hill

1 joint publications

Kai Dührkop

1 joint publications

Sebastian Böcker

1 joint publications

Federico Zahariev

1 joint publications

Tamalika Ash

1 joint publications

Erin Stender

Frequent Collaborators

2 joint publications

David F Grant

1 joint publications

Philipp Pracht

1 joint publications

José A Gascón

1 joint publications

Stefan Grimme

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