• Principal OR Sr. Principal Computational

    Northrop Grumman (Jessup, MD)
    …a completion date prior to start with 1 year of relevant technical experience; PhD in computational chemistry , applied mathematics, computer science, physics ... STEM field with 6 years of relevant technical experience; PhD in applied mathematics, computational chemistry , computer science, physics or a relevant… more
    Northrop Grumman (12/05/25)
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  • Computational Chemist Lead

    Astellas Pharma (Cambridge, MA)
    …**Purpose:** This role supports drug discovery efforts by applying advanced computational chemistry techniques to design and optimize small-molecule ... candidate will lead strategy across multiple programs and shapes the computational chemistry platform/standards in Innovation Lab, working closely with… more
    Astellas Pharma (10/11/25)
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  • Principal Scientist, Computational

    Frontier Medicines (Boston, MA)
    …seeking a highly motivated individual to fill the position of Principal Scientist, Computational Chemistry . The successful candidate will play a leading role in ... What will you be doing? + Design, execute, and analyze computational chemistry studies using a wide range of ligand-based, structure-based, and physics-based… more
    Frontier Medicines (11/04/25)
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  • Computational Infrastructure Scientist…

    Lilly (Indianapolis, IN)
    …design decisions to promote reuse and institutional knowledge. **Basic Qualifications:** + PhD in Computational Biology, Chemistry , Bioinformatics, or a ... for people around the world. We are seeking a Computational Infrastructure Scientist to help build and extend the...This is a scientific engineering position, ideal for a PhD -level scientist who bridges biology, computation, and informatics. The… more
    Lilly (11/21/25)
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  • Associate Director, Computational

    Takeda Pharmaceuticals (Boston, MA)
    …life-changing therapies to patients worldwide. **_Objective / Purpose:_** + As a Senior Computational Chemistry Leader, you will work as part of a ... role supports small molecule research initiatives across Takeda research sites, leading computational chemistry efforts to drive project progression at both… more
    Takeda Pharmaceuticals (11/05/25)
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  • Software Engineer - Cheminformatics…

    ManpowerGroup (Columbus, OH)
    …across cheminformatics platforms. **Qualifications** + PhD or Master's in Chemistry , Cheminformatics, Computational Chemistry , or related field ... **Principal Scientist - Cheminformatics & Computational Chemistry ** **Location: Columbus OH** **On-Site** **Rate: $55hr with benefits | does not include PTO**… more
    ManpowerGroup (10/03/25)
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  • Postdoctoral Appointee - Computational

    Argonne National Laboratory (Lemont, IL)
    …for energy storage and conversion and their characterization with advanced computational chemistry tools, including molecular dynamics, density functional theory ... (HPC) systems and intelligent workflows. + Demonstrated expertise combining AI and computational chemistry software in HPC platforms for materials science… more
    Argonne National Laboratory (12/18/25)
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  • Computational Beamline / Plasma Scientist…

    Applied Materials (Gloucester, MA)
    …or Ph.D. program in Physics, Electrical Engineering, Nuclear Engineering, Mechanical Engineering, Chemistry , or a related field. + Student must be in good academic ... standing at their university, with a GPA of 3.0 or above on a 4.0 scale. + Experience in ion beam transport, magnet design or plasma modeling preferred. + Quick learner. **2026 Summer Internship program start/end dates:** Tuesday, May 26 - Friday, August 14… more
    Applied Materials (11/21/25)
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  • Associate or Full Professor - Computational

    CUNY (New York, NY)
    …Biochemistry seeks a mid- to senior-career hire (Associate/Full Professor) in Computational Chemistry /Materials Science, or closely related field. The successful ... research effort building on research strengths in bio-inspired materials, sustainable chemistry , nanotechnology and computational chemistry , with a… more
    CUNY (11/21/25)
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  • Computational Biologist, Principal…

    Bayer (Cambridge, MA)
    PhD degree with post-graduation experience in Sciences (Bioinformatics, Computational Biology, Biology, Chemistry , Genetics, Computer Science, Informatics, ... + 5+ years of post-graduation experience in Sciences (Bioinformatics, Computational Biology, Biology, Chemistry , Genetics, Computer Science, Informatics,… more
    Bayer (12/03/25)
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  • Senior Computational Chemist

    Fujifilm (Mesa, AZ)
    …up to 10 percent may be required. **REQUIREMENTS** + PhD in Chemistry , Computer Science, Materials Science, Chemical Engineering, Computational Chemistry ... an exciting opportunity at our Mesa, AZ facility for a **Senior Computational Chemist!** With state-of-the-art manufacturing facilities in the US, Europe, Taiwan,… more
    Fujifilm (12/16/25)
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  • Executive Director, Computational Safety

    Boehringer Ingelheim (Ridgefield, CT)
    …and influence global governance. **Requirements** * Ph.D. degree in Computational Biology/ Chemistry /Toxicology, Bioinformatics, Computer Science, Data Science, ... We are seeking a visionary leader to build and lead our Computational Safety team, shaping strategy and delivering impactful solutions across therapeutic portfolios.… more
    Boehringer Ingelheim (12/06/25)
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  • Computational Mechanical Engineer

    Johns Hopkins Applied Physics Laboratory (Laurel, MD)
    …above and beyond our minimum requirements if you have + An MS or PhD in Mechanical Engineering, Physics, Applied Mathematics, Chemistry , Materials Science, or ... of all kinds? Are you searching for impactful work in the area of computational engineering and analysis that doesn't confine you to working on the same thing… more
    Johns Hopkins Applied Physics Laboratory (12/09/25)
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  • Postdoctoral Appointee - MSD Computational

    Argonne National Laboratory (Lemont, IL)
    Argonne National Laboratory seeks a Postdoctoral Appointee to perform computational research on materials for thermal and electrochemical interfaces. The successful ... design rules relating synthesis to thermal and chemical properties; provide computational guidance to experimental synthesis. + Collaborate closely with experimental… more
    Argonne National Laboratory (11/20/25)
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  • Assistant Professor - Computational Earth…

    Stony Brook University (Stony Brook, NY)
    …to carry out a program of research in the broadly-defined area of computational materials chemistry with applications to the geosciences that may complement ... fundability of research, + experience with, and demonstrated expertise in computational materials chemistry , + potential for collaboration within the… more
    Stony Brook University (09/27/25)
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  • Post Doctoral Associate (Jones Lab) - RNA…

    New York University (New York, NY)
    …RNA structure, RNA-protein interactions, and dynamics, with a machine learning and computational chemistry focus. Successful applicants will be highly motivated ... The Jonesy lab in the Chemistry Department of NYU is looking for a...must hold a Ph.D. degree in a related field ( Chemistry , Biochemistry, Chemical Biology, Biophysics). The ideal candidate will… more
    New York University (11/26/25)
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  • Assistant or Associate Professor of Advanced…

    Rice University (Houston, TX)
    Assistant or Associate Professor of Advanced Computational Materials Tenure-Track Faculty Opening with the Rice Advanced Materials Institute School of Engineering ... and/or Associate Professor position in the area of advanced computational and/or applied artificial intelligence (AI)/machine learning (ML)-informed materials… more
    Rice University (12/02/25)
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  • Postdoctoral Fellow, Computational Genetic…

    AbbVie (North Chicago, IL)
    …Discovery, Development Sciences, and Aesthetics which includes fields such as chemistry , biology, pharmaceutical science, and computational information sciences. ... journals and present at scientific conferences Qualifications Basic Qualifications + PhD in Computational Biology, Bioinformatics, Computer Science, Human… more
    AbbVie (11/06/25)
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  • Principal Scientist I / II, Medicinal…

    Schrodinger (Cambridge, MA)
    … platform for rapid advancement of drug discovery programs **What you should have:** + PhD in synthetic organic or medicinal chemistry + At least four years of ... We're looking to hire a **Principal Scientist in Medicinal Chemistry ** to join us in our mission to discover...that improve human health through the use of breakthrough computational methods. Our drug discovery and early clinical development… more
    Schrodinger (10/11/25)
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  • Senior Principal Scientist / Director, Medicinal…

    Schrodinger (NY)
    Chemistry team and the broader Therapeutics Group **What you should have:** + PhD in synthetic organic or medicinal chemistry + At least eight years of ... hire a **Senior Principal Scientist** or **Director of Medicinal Chemistry ** to join us in our mission to discover...that improve human health through the use of breakthrough computational methods. Our drug discovery and early clinical development… more
    Schrodinger (10/11/25)
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