370 senior computational scientist jobs at 202 companies in United States

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Senior Computational Research Scientist
United States
$104k-$186k/yr RemoteFull Time
St. Jude Children's Research Hospital
St. Jude Children's Research Hospital: Pediatric research hospital treating children with catastrophic diseases.
7+ YOEBachelor's degree in bioinformatics, molecular biology, biochemistry, computer science or related field; 7+ years relevant experience; Master’s or PhD preferred; strong computational chemistry skills; HPC experience; experience with MD simulations, docking, QSAR; proficient in R and Python; knowledge of Knime, RDKit, ChemProp is a plus.
Python, R, RDKit, Knime, ChemProp, Molecular Dynamics, Molecular Docking, QSAR, Pharmacophore Modeling, Chemoinformatics
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Senior/Principal Scientist, Computational Biology
Boston or United States
$150k-$225k/yr OnsiteFull Time
Cellular Intelligence
Cellular Intelligence: AI-driven cellular biology advancing AI-enabled biology research.
3+ YOEPhD in Computational Biology or related field; 3+ years of genomic/transcriptomic data analysis; strong Python (scanpy/anndata) skills; quantitative expertise; biology-focused interpretation.
Python, scanpy, anndata, single-cell tooling
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Lead Computational Scientist
Rochester, New York, United States
$87k-$130k/yr OnsiteFull Time
University of Rochester
University of Rochester: Provides higher education, medical research, and healthcare services.
3+ YOEPhD or equivalent with 3+ years experience; expertise in HPC, scientific application development/porting, data analysis pipelines, parallel programming, and mentoring students; strong communication and project management skills.
C/C++, Fortran, Java, Perl, Python, R, MPI, OpenMP, CUDA
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Pathology Computational Scientist
Boston, Massachusetts, United States
$94k-$137k/yr OnsiteFull Time
Mass General Brigham: Provides integrated medical care, research, and clinical training services.
Experience in microbiome bioinformatics and machine learning, advanced deep learning skills, Python and PyTorch experience preferred, Git and SLURM familiarity, ability to manage large biomedical datasets and contribute to publications/grants.
Python, PyTorch, Git, SLURM
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Senior Scientist, Computational Biology
South San Francisco or Seattle or London
$136k-$170k/yr OnsiteFull Time
Xaira Therapeutics
Xaira Therapeutics: Develops AI models for protein and antibody drug discovery.
5+ YOEPhD in a quantitative biology field, 5+ years industry/applied research, deep single-cell RNA‑seq and Perturb‑seq expertise, experience integrating large-scale datasets, production workflow development (Nextflow), Docker, AWS, Python (numpy, pandas, scanpy, scikit-learn), Unix, and GitHub.
Nextflow, Docker, AWS, Python, numpy, pandas, scanpy, scikit-learn, Unix, GitHub
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Senior Computational Social Scientist
Washington, District of Columbia, United States
$82k-$130k/yr HybridFull Time
Protagonist
Protagonist: Provides data-driven narrative analytics and strategic communication consulting.
3+ YOEEligible for US government contracts; degree in a quantitative/analytical field or equivalent experience; 5+ years relevant (or 3+ with advanced degree) including 2+ years data science; hands-on text-as-data experience; Python/R and SQL proficiency; NLP and LLM experience; strong communication skills.
Python, R, SQL, Tableau, Superset, Narrative Analytics™, LLMs, transformers, RAG
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Senior Scientist, Computational Biology - Contract
Somerville, Massachusetts, United States
$74-$80/hr OnsiteContract
Tessera Therapeutics
Tessera Therapeutics: Develops gene writing technology to treat and cure diseases.
5+ YOEPhD (5+ yrs) or MS (10+ yrs) or BS (12+ yrs); broad genome editing and off-target discovery knowledge; NGS data and QC; developing and troubleshooting NGS pipelines in cloud; Nextflow/Dagster; AWS, version control, and software development best practices.
Nextflow, Dagster, AWS, NGS, CI/CD, AI agents
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Sr. Scientist, Computational Chemistry
San Diego, California, United States
$111k-$151k/yr OnsiteFull Time
Neurocrine Biosciences
Neurocrine BiosciencesNASDAQ: NBIX: Develops pharmaceuticals for neurological, endocrine, and psychiatric disorders.
5+ YOEExpertise in computational chemistry, molecular modeling, ML/AI for drug discovery, protein-ligand modeling, molecular dynamics, and scripting; ability to drive discovery projects and present results.
python, C++, R, Schrodinger, CCG, Open Eye
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Scientist/Senior Scientist, Computational Biology
New York, New York, United States
$140k-$180k/yr OnsiteFull Time
Volastra Therapeutics
Volastra Therapeutics: Develops cancer therapeutics targeting chromosomal instability in solid tumors.
PhD or equivalent in bioinformatics/comp biology; strong Python/R; experience with high-throughput sequencing; cloud/HPC; cross-disciplinary communication; AI coding tools.
Python, R, Unix, Linux, Bash, Cloud, High-Performance Computing, LLM-based development tools
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Scientist, Computational Chemist & MLOps Engineer
Madison or Pasadena or San Diego or Verona
$100k-$125k/yr OnsiteFull Time
Arrowhead Pharmaceuticals
Arrowhead PharmaceuticalsNASDAQ: ARWR: Develops RNAi medicines to treat genetic and intractable diseases.
Bachelor's or Master's in a related field; strong Python, Linux, and Git skills; foundational statistics and ML knowledge; experience with biological/omics datasets, reproducible workflows, and scientific software; PhD preferred for senior levels.
Python, Linux, Git, HPC
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Senior Scientist - Principal Scientist, Computational Chemistry
Boston, Massachusetts, United States
OnsiteFull Time
Superluminal Medicines
Superluminal Medicines: Accelerates small molecule drug discovery using generative AI.
1+ YOEPhD in Computational Chemistry or related field; 1-3+ years biotech/pharma experience; strong physics-based and ML modeling; excellent communication; design-experience with medicinal chemistry; structure-based drug discovery innovation.
Schrodinger suite, OpenEye, MOE, Python, RDKit, scikit-learn, numpy, pandas, pytorch
2w
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Staff Computational Scientist, Magnetic Materials
United States
$224k-$420k/yr HybridFull Time
SandboxAQ
SandboxAQ: Develops AI and quantum technology for cybersecurity and science.
5+ YOE5+ MgmtPhD in materials science/physics/chemistry,5+ years post-PhD leading magnetic materials programs,experience translating modeling to manufacturable magnet formulations,team leadership,publication and patent record.
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Senior Scientist - Computational Protein Design
South San Francisco, California, United States
$146k-$198k/yr OnsiteFull Time
Amgen
AmgenNASDAQ: AMGN: Develops and manufactures biotechnology medicines for serious diseases.
PhD/MD/PharmD or Master’s with relevant protein design experience; strong computational design background; programming in Python; experience with AI/ML in protein design; cross-functional collaboration.
Python, AlphaFold, ProteinMPNN, RFdiffusion, Cloud computing, HPC
3w
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Computational Plasma Scientist - MHD
Everett, Washington, United States
$150k-$200k/yr OnsiteFull Time
Helion
Helion: Building fusion reactors to produce clean, low-cost electricity.
PhD in a related field; experience running, analyzing, and interpreting MHD simulations; knowledge of magnetic diffusion, eddy currents, and FRC physics; scripting in MATLAB/Fortran/C/Python; experience with simulation studies and model validation.
MATLAB, Fortran, C, Python
3w
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Scientist - Computational Biophysics
Emeryville, California, United States
$100k-$180k/yr OnsiteFull Time
Astera Institute
Astera Institute: Conducts fundamental research in artificial intelligence and longevity science.
PhD in bioinformatics/computational biology/ML, strong protein structure knowledge, experience building large bioinformatic pipelines and managing high-dimensional datasets, proficiency fine-tuning ML models and integrating PLM/LLM/experimental data.
PLM, LLM, ESM, AlphaFold, Transformer
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Staff Computational Scientist, Grid Optimization, Tapestry
Mountain View, California, United States
$207k-$300k/yr HybridFull Time
Alphabet
AlphabetNASDAQ: GOOGL: Holding providing internet, software, and AI services.
6+ YOEMaster's or PhD in STEM, 6+ years in modeling and optimization, strong power systems knowledge, numerical methods and solver experience, ability to produce production-ready code, collaborative across disciplines.
Python, Java, C/C++, JAX, Julia, AWS, GCP, Azure
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Senior Scientist, Computational Biotherapeutics Engineering
Cambridge, Massachusetts, United States
$94k-$156k/yr HybridFull Time
Pfizer
PfizerNYSE: PFE: Develops and manufactures vaccines and medicines for global healthcare
0+ YOEPhD or Master’s with relevant years; experience with AI/ML for protein design; Python and ML libraries; large biological datasets.
Python, NumPy, SciPy, scikit-learn, PyTorch
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Senior Scientist I/II, Computational Biology & AI
North Chicago, Illinois, United States
$110k-$209k/yr HybridFull Time
AbbVie
AbbVieNYSE: ABBV: Develops and sells innovative pharmaceutical and biopharmaceutical medicines.
4+ YOEStrong biology/toxicology foundation with computational skills; proficiency in Python or R; experience with statistical and ML methods applied to biological safety datasets; cross-functional leadership and scientific communication.
Python, R
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Computational Scientist for Electronic Structure Method Development
Golden, Colorado, United States
$84k-$151k/yr OnsiteFull Time
National Laboratory of the Rockies
National Laboratory of the Rockies: Conducts applied research in energy systems and technology innovation.
3+ YOEPhD (or MS +3 yrs or BS +5 yrs) in a relevant field; demonstrated research and software development experience with Questaal or electronic-structure codes; proposal development and project management experience; strong technical writing and communication; ability to obtain DOE site access and a federal PIV card.
Questaal, Git, HPC, E-Verify
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Senior Scientist, Computational Safety & Exploratory Pharmacology
West Point, Pennsylvania, United States
$106k-$167k/yr OnsiteFull Time
Merck & Co.
Merck & Co.NYSE: MRK: Produces prescription medicines, vaccines, and animal health products.
4+ YOEMS or PhD-level biomedical engineer or integrative systems scientist with experience in physiologic signal processing, computational modeling, Python/MatLab/R proficiency, and nonclinical signal analysis.
Python, MatLab, R