Daniel Reker

Assistant Professor

Duke University
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United States

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About

Daniel Reker is an Assistant Professor at Duke University in the United States. His research primarily focuses on the application of machine learning in drug discovery and development, including the design of nanoparticles for drug delivery and the optimization of peptide drug design. Recent publications highlight his work on active learning methodologies for identifying potent compounds and analyzing molecular interactions in preclinical cancer research.

Recent Grants

Grant: Close

Predicting the effects of microbial metabolites on NOD-like receptors

Open Date: 2021-08-01

Close Date: 2022-07-01

Grant: Close

Identifying the molecular mediators of microbiome-host interactions through machine learning

Open Date: 2021-03-01

Close Date: 2022-02-01

Grant: Close

Harnessing AI to design vaccines for treating metastatic skin cancer

Open Date: 2018-09-01

Close Date: 2019-10-01

Grant: Close

Discovery and analysis of adverse reactions of inactive ingredients

Open Date: 2018-02-01

Close Date: 2019-08-01

Grant: Close

Active learning for late-stage drug design

Open Date: 2018-01-01

Close Date: 2019-06-30

Positions (1)

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Daniel Reker

University Name
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Duke University

Postdoctoral Associate in AI-Guided Antibiotic Prodrug Design

Duke University is hiring a Postdoctoral Associate in AI-guided antibiotic prodrug design within the Reker Lab at the Duke University Pratt School of Engineering. This opportunity is ideal for researchers with interests in computational chemistry , cheminformatics , molecular machine learning , predictive modeling , and generative modeling for small molecules . The project focuses on generative design of small-molecule prodrugs and infection-responsive linker chemistries, prediction of bioactivity, prodrug activation, ADMET, and molecular properties, plus multi-objective optimization and prospective molecular design. The postdoc will work in a highly collaborative, interdisciplinary environment with medicinal chemists and microbiologists, contributing to iterative design–synthesize–test–learn workflows and downstream preclinical evaluation with international collaborators. The position is especially suited to a result-oriented scientist who wants computational predictions translated quickly into experimental outcomes. Eligibility: Applicants should have completed a PhD by the appointment start date in computational chemistry, cheminformatics, chemistry, chemical engineering, biomedical engineering, computer science, pharmaceutical sciences, or a related field. Funding: The role is supported by a newly funded Wellcome Leap Focused Antibiotics project. Salary/stipend details are not listed in the post. Start date: Preferred immediately, with flexibility. How to apply: Submit an application through the linked AcademicJobsOnline posting. Review the posting carefully and prepare the required materials before applying.

Articles (17)

Collaborators (4)

Tiago Rodrigues

Assistant Professor

Faculty of Pharmacy, University of Lisbon

PORTUGAL

Andżelika Lorenc

Nicolaus Copernicus University

POLAND

Guang Lin

Purdue University

UNITED STATES

Pei Zhou

Professor of Biochemistry and Chemistry

Duke University

UNITED STATES
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