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Paul Helquist

12PUBLICATIONS

27CO-AUTHORS

Chemical and thermal processes in energy and combustionGlycoconjugatesBiomolecular modelling and designOrganometallic chemistrySemi- and unsupervised learning

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Publications (12)

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|Dec 30, 2025

Rapid FF Generation via Hessian-Informed Initial Parameters and Automated Refinement.

Mikaela Farrugia, Paul Helquist, Per-Ola Norrby

|Dec 06, 2024

Synthesis of Caged HMG-CoA Reductase Substrates for the Elucidation of Cellular Pathways.

Ryan J O'Connell, Nicholas J Dolphin, Guillermo Ferraudi

|Jul 12, 2024

Finding Relevant Retrosynthetic Disconnections for Stereocontrolled Reactions.

Olaf Wiest, Christoph Bauer, Paul Helquist

|May 23, 2023

Computational Study of Base-Catalyzed Thiohemiacetal Decomposition in <i>Pseudomonas mevalonii</i> HMG-CoA Reductase.

Himani N Patel, Brandon E Haines, Cynthia V Stauffacher

|May 01, 2023

Negative Data in Data Sets for Machine Learning Training.

Michael P Maloney, Connor W Coley, Samuel Genheden

|May 01, 2023

Negative Data in Data Sets for Machine Learning Training.

Michael P Maloney, Connor W Coley, Samuel Genheden

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Frequent Collaborators

11 joint publications

Olaf Wiest

8 joint publications

Per-Ola Norrby

3 joint publications

Samuel Genheden

2 joint publications

Anthony R Rosales

2 joint publications

Nessa Carson

2 joint publications

Brandon E Haines

2 joint publications

Connor W Coley

2 joint publications

Michael P Maloney

1 joint publications

Calvin N Steussy

1 joint publications

Xuhui Huang

Frequent Collaborators

11 joint publications

Olaf Wiest

8 joint publications

Per-Ola Norrby

3 joint publications

Samuel Genheden

2 joint publications

Anthony R Rosales

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