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Molecular Design Scientist

Company: VirtualVocations
Location: Arlington
Posted on: November 11, 2024

Job Description:

A company is looking for a Scientist in Molecular Design within the Computational & Data Sciences team.



Key Responsibilities

Design focus libraries and productionize library design methods using proprietary ML models
Develop metrics to assess and improve library designs
Extract insights from large proprietary screening datasets in collaboration with data scientists and cheminformaticians


Required Qualifications

BS/MS/Ph.D in computational, organic, or medicinal chemistry, or a related field
Experience designing small-molecule libraries for virtual screens, DEL screens, and/or HTS
Experience triaging large datasets from virtual screens, DEL screens, and/or HTS
Proficient in Python and the PyData stack (numpy, pandas, scipy, scikit-learn, etc.)
Familiarity with RDKit and molecular simulation suites (Schrodinger, MOE, etc.)

Keywords: VirtualVocations, Lancaster , Molecular Design Scientist, Other , Arlington, Pennsylvania

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