Olaf Wiest

University of Notre Dame

United States

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Articles (16)

Year:

2025

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2024

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2024

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2024

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2023

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2023

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2023

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2023

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2023

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2023

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2022

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2022

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2022

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2022

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2021

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2021

Collaborators (6)

Cynthia Stauffacher

Purdue University

UNITED STATES

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Oscar Pàmies

Associate Professor

Universitat Rovira i Virgili

SPAIN

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Brandon L. Ashfeld

University of Notre Dame

UNITED STATES

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Elizabeth H. Krenske

University of Queensland

AUSTRALIA

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Paul Helquist

Professor, Chair and Associate Chair

University of Notre Dame

UNITED STATES

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Brandon E. Haines

Westmont College

UNITED STATES

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Olaf Wiest

Research Interests

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Articles (16)

Improving reaction prediction through chemically aware transfer learning

Finding Relevant Retrosynthetic Disconnections for Stereocontrolled Reactions

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

Data-Efficient, Chemistry-Aware Machine Learning Predictions of Diels–Alder Reaction Outcomes

Computational Study of Base-Catalyzed Thiohemiacetal Decomposition in Pseudomonas mevalonii HMG-CoA Reductase

Negative Data in Data Sets for Machine Learning Training

Negative Data in Data Sets for Machine Learning Training

Elucidating Residue-Level Determinants Affecting Dimerization of Ebola Virus Matrix Protein Using High-Throughput Site Saturation Mutagenesis and Biophysical Approaches

Interplay of Computation and Experiment in Enantioselective Catalysis: Rationalization, Prediction, and─Correction?

A Proline-Squaraine Ligand Framework (Pro-SqEB) for Stereoselective Rhodium(II)-Catalyzed Cyclopropanations

A Quantum-Guided Molecular Mechanics Force Field for the Ferrocene Scaffold

Automated fitting of transition state force fields for biomolecular simulations

Front Cover: Rational Design and Identification of Harmine‐Inspired, N‐Heterocyclic DYRK1A Inhibitors Employing a Functional Genomic In Vivo Drosophila Model System (ChemMedChem 4/2022)

Rational Design and Identification of Harmine‐Inspired, N‐Heterocyclic DYRK1A Inhibitors Employing a Functional Genomic In Vivo Drosophila Model System**

Proofreading experimentally assigned stereochemistry through Q2MM predictions in Pd-catalyzed allylic aminations

A Phosphine-Mediated Dearomative Skeletal Rearrangement of Dianiline Squaraine Dyes

Collaborators (6)

Cynthia Stauffacher

Oscar Pàmies

Brandon L. Ashfeld

Elizabeth H. Krenske

Paul Helquist

Brandon E. Haines

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