• Associate Principal Scientist: Molecular

    Merck (West Point, PA)
    **Job Description** **Associate Principal Scientist: Molecular Modeling , Analytical Research & Development** Our Scientists are our Inventors. We deliver robust ... including critical IT collaborators. **Primary Responsibilities** + Expert execution of atomistic molecular modeling and molecular dynamics simulations +… more
    Merck (06/07/25)
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  • Senior Scientist I Computational Chemistry

    AbbVie (North Chicago, IL)
    …overall vision of advancing first-in-class and best-in-class clinical candidates. Computational chemists focus on developing hierarchical modeling approaches, ... including physics-based atomistic modeling , encompassing Molecular Dynamics (MD) and Quantum Mechanics (QM), Machine learning...PhD with 8+ (BS), 5+ (MS), and 0-3 ( PhD ) years of experience in computational chemistry,… more
    AbbVie (06/14/25)
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  • Postdoctoral Fellow - Computational

    MD Anderson Cancer Center (Houston, TX)
    …mathematics and computational science who has a career interest in modeling complex, dynamic biological systems, including tissues and the human immune system, ... A postdoctoral fellow position is available in the Department of Bioinformatics & Computational Biology. We are seeking a researcher with strong training in… more
    MD Anderson Cancer Center (06/03/25)
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  • Senior Scientist, Computational Chemistry

    Merck (West Point, PA)
    …and techniques + informative data analysis and visualization + development of innovative computational workflows for molecular modeling + protein construct ... emphasis. **Required Experience and Skills:** + Proficiency in general molecular modeling techniques (docking, molecular simulation, homology… more
    Merck (06/14/25)
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  • Principal Scientist, Peptide Computational

    Merck (Rahway, NJ)
    …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 (05/21/25)
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  • Sr. Scientist, Computational Chemistry

    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 + 2+ years of Industry… more
    Takeda Pharmaceuticals (06/11/25)
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  • Senior Computational Scientist

    University of Utah (Salt Lake City, UT)
    …**Job Title** Bioinformatics Data Analyst II **Working Title** Senior Computational Scientist **Job Grade** G **FLSA Code** Administrative **Patient Sensitive ... of Utah School of Medicine, is accepting applications for a Senior Computational Scientist. The successful candidate will lead collaborative efforts among basic and… more
    University of Utah (04/19/25)
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  • Postdoctoral Appointee - Computational

    Argonne National Laboratory (Lemont, IL)
    modeling using high-performance computing (HPC) infrastructure. + Validate computational predictions by collaborating with experimental groups conducting reverse ... are seeking a highly motivated Postdoctoral Researcher with expertise in computational biology, deep mutational scanning data, and generative artificial intelligence… more
    Argonne National Laboratory (06/03/25)
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  • Postdoctoral Appointee - Computational

    Argonne National Laboratory (Lemont, IL)
    …In addition, computational fluid dynamics (CFD) simulations combined with microkinetic modeling will be carried out to study the heat transfer of the reaction ... the structures and to understand the complex mechanisms of molecular reactions occurring at the surface of various materials....(eg, the use of OpenFoam or ALDFoam) and microkinetic modeling is critical + Considerable computational expertise… more
    Argonne National Laboratory (05/31/25)
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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 (06/11/25)
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  • Co-op - Computational Lab

    United Therapeutics (Silver Spring, MD)
    …for which transplant is not currently an option. **How you'll contribute** UT's computational systems biology lab in Silver Spring, MD is building an in-silico model ... will assist in the development and implementation of mathematical models of molecular and physiological processes that regulate lung diseases and drug response. This… more
    United Therapeutics (05/17/25)
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  • Postdoctoral Fellow - Computational

    MD Anderson Cancer Center (Houston, TX)
    …Blood 2021; Cell Reports 2021). We are especially interested in Fellows with computational or (epi)genomic expertise to develop new molecular tools that capture ... cell culture and immunologic approaches. *ELIGIBILITY REQUIREMENTS* Individuals with a PhD degree in cancer biology, molecular biology, genomics, genetics,… more
    MD Anderson Cancer Center (03/23/25)
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  • Postdoctoral Fellow - Cancer Computational

    MD Anderson Cancer Center (Houston, TX)
    …available in Professor Wenyi Wang's lab at the Department of Bioinformatics and Computational Biology, the University of Texas MD Anderson Cancer Center. Dr. Wang's ... DNA-seq and RNA-seq * Single-cell RNA-seq * Spatial transcriptomics * Develop computational and statistical methods for multi-omic and single-cell data * Integrate… more
    MD Anderson Cancer Center (06/10/25)
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  • Advisor - Fragment-based Computational

    Lilly (San Francisco, CA)
    …technologies to improve hit finding, mechanism of action exploration, and molecular design. Through agile, hypothesis-driven research, we turn high-potential ideas ... **Position Summary** Lilly Small Molecule Discovery is seeking a ** Computational Scientist** to join our **Novel** **Platforms** **Fragment-based Discovery** team.… more
    Lilly (06/15/25)
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  • Post Doctoral Associate in the Center…

    University of Florida (Gainesville, FL)
    …Doctoral Associate in the Center for Molecular Magnetic Quantum Materials (M2QM) Apply now ... Classification Title: Post Doctoral Associate Job Description: The Center for Molecular Magnetic Quantum Materials (M2QM) at the Department of Physics, University… more
    University of Florida (04/13/25)
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  • Principal Scientist (AI/ML) - Predictive…

    Bristol Myers Squibb (Cambridge, MA)
    …for biologics discovery and design. This role is an integral part of our ** Computational Design and Predictive Modeling team** , which sits at the interface ... data and antibody repertoires to develop innovative, accurate , and scalable computational solutions that guide molecular design and optimization efforts. You… more
    Bristol Myers Squibb (06/09/25)
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  • Senior Program Officer, Malaria Modeling

    Bill and Melinda Gates Foundation (Seattle, WA)
    …in a quantitative field (eg, Statistics/Biostatistics, Applied Mathematics, Economics, Epidemiology, Computational Biology), PhD in a quantitative field is a ... data, as well as invest in the roll-out of next-generation technologies, like molecular surveillance and digital transformation of country programs. Your Role As the… more
    Bill and Melinda Gates Foundation (05/30/25)
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  • Assoc Dir , Representation Learning, Data Science

    Merck (Cambridge, MA)
    …familiarity with ML frameworks (eg, TensorFlow, PyTorch). + Strong understanding of molecular modeling software and tools (eg, RDKit, OpenMM, AlphaFold, ... a focus on developing and applying advanced methods for molecular and protein design. This role will involve creating...with cloud computing platforms (eg, AWS, Google Cloud) for computational modeling and data analysis. + Familiarity… more
    Merck (05/23/25)
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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 (06/15/25)
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  • Postdoctoral Fellowship

    Johns Hopkins University (Baltimore, MD)
    …Calibration for Precision Medicine Lead the development of a novel computational framework that synergistically combines mathematical modeling , artificial ... targets and mechanisms of response and resistance. Qualifications and Background PhD or equivalent in computational biology, bioinformatics, computer science,… more
    Johns Hopkins University (04/22/25)
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