Fiona L. Kearns

Orcid: 0000-0002-5469-9035

According to our database1, Fiona L. Kearns authored at least 6 papers between 2017 and 2024.

Collaborative distances:

Timeline

2017
2018
2019
2020
2021
2022
2023
2024
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Article 
PhD thesis 
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Links

On csauthors.net:

Bibliography

2024
Mining for Potent Inhibitors through Artificial Intelligence and Physics: A Unified Methodology for Ligand Based and Structure Based Drug Design.
J. Chem. Inf. Model., 2024

Breaking Down the Bottlebrush: Atomically Detailed Structural Dynamics of Mucins.
J. Chem. Inf. Model., 2024

2023
#COVIDisAirborne: AI-enabled multiscale computational microscopy of delta SARS-CoV-2 in a respiratory aerosol.
Int. J. High Perform. Comput. Appl., 2023

2022
CIFDock: A novel CHARMM-based flexible receptor-flexible ligand docking protocol.
J. Comput. Chem., 2022

2019
Modeling Boronic Acid Based Fluorescent Saccharide Sensors: Computational Investigation of d-Fructose Binding to Dimethylaminomethylphenylboronic Acid.
J. Chem. Inf. Model., 2019

2017
Computing converged free energy differences between levels of theory via nonequilibrium work methods: Challenges and opportunities.
J. Comput. Chem., 2017


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