• Principal Machine Learning Scientist…

    Novo Nordisk (Lexington, MA)
    …departments within AI and Digital Research (AIDR), in particular the department of Molecular AI within Computational Drug Design, to drive the applications of ... global network to invent novel medicines by applying advanced computational techniques and developing innovative computational methods....and technology. The Position The Principal ML Scientist - Molecular AI will be a critical team member of… more
    Novo Nordisk (03/04/25)
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  • Head of Computational Chemistry

    Takeda Pharmaceuticals (Boston, MA)
    …selection + Extensive knowledge of computational chemistry tools, including docking, molecular dynamics, FEP, QSAR modeling , and generative AI + Strong ... a close and strategic partnership with global chemistry for molecular design and developing a roadmap for computational...pharmacologists, DMPK scientists as well as leading and mentoring computational chemistry teams. + PhD in … more
    Takeda Pharmaceuticals (02/08/25)
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  • Principal Scientist, Peptide Computational…

    Merck (Boston, MA)
    …opportunities for impact now and in the future + Expertise in general molecular modeling techniques (docking, molecular simulation, homology modeling ... techniques as a member of discovery teams + Advancing our peptide modeling capabilities through invention of novel computational methodologies as necessary to… more
    Merck (04/29/25)
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  • Sr. Scientist, NS Computational Biology

    Takeda Pharmaceuticals (Boston, MA)
    …**Job Description** **_Objective / Purpose:_** Join Takeda as a Senior Scientist, Computational biologist, and become part of a global team that leverages ... cutting-edge computational biology and AI/ML techniques to rigorously identify and...novel drug targets and biomarkers, stratify patients and elucidate molecular , cellular mechanisms of action, support indication expansion. +… more
    Takeda Pharmaceuticals (03/04/25)
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  • Research (Scientific) Associate Director,…

    Takeda Pharmaceuticals (Boston, MA)
    … computational tools and methodologies including docking, virtual screening, molecular dynamics, free energy perturbation, homology modeling , quantum ... in computational chemistry/AI **EDUCATION, BEHAVIOURAL COMPETENCIES AND SKILLS:** + PhD degree in a relevant scientific discipline + 6+ years of Industry… more
    Takeda Pharmaceuticals (02/07/25)
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  • Computational Materials Science Intern

    Bosch (Watertown, MA)
    …Circuit Design, Semiconductors and Wireless, and MEMS Advanced Design._ _The Computational Materials Science team in Watertown specializes in atomistic and mesoscale ... are seeking highly motivated and skilled interns for a 3-6 month internship in our Computational Materials Science team. The intern will focus on one or more of the… more
    Bosch (04/23/25)
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  • Senior Scientist, Computational Protein…

    AbbVie (Worcester, MA)
    …and self-motivated data scientist with a passion for leveraging AI/ML in computational protein design? Join AbbVie's Discovery Biotherapeutics team as a Senior ... In this pivotal role, you will utilize your expertise in AI/ML and computational protein design to drive the development of cutting-edge biotherapeutics. You'll have… more
    AbbVie (05/03/25)
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  • Staff Engineer - Modeling and Simulations

    Takeda Pharmaceuticals (Boston, MA)
    …formation pathways. + Computational Chemistry & Simulation: Utilize DFT, Molecular Dynamics (MD), and kinetic modeling to rationalize mechanistic hypotheses, ... scalable, and sustainable reaction processes. This role will focus on kinetic modeling , mechanistic understanding, and use computational tools to guide route… more
    Takeda Pharmaceuticals (03/28/25)
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  • Head of AI/ML Research

    Takeda Pharmaceuticals (Boston, MA)
    …of disease biology. The ideal candidate will have a strong background in computational biology, machine learning, and structural modeling , combined with proven ... with 23+ years experience + 10+ years of research experience in AI/ML, computational drug design, structural modeling , or related disciplines within the… more
    Takeda Pharmaceuticals (03/16/25)
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  • Associate Director, Early Translational…

    Bristol Myers Squibb (Cambridge, MA)
    … computational research in areas that include genomic, structural and molecular informatics, computational and systems biology, patient selection and ... the brightest minds in biopharma. We seek a creative and passionate computational scientist with a background in addressing neuroscience translational questions to… more
    Bristol Myers Squibb (04/28/25)
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