Find jobs in AI/ML, Data Science and Big Data
24 results
for Molecular Dynamics
(Skill/Tech stack)
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Materials Science Applications Scientist EUR 65K-65KClassical molecular dynamics | Coarse Grained Modeling | Machine Learning | Mechanical modeling | Molecular DynamicsBahncard 50 | Bike leasing | Corporate counseling service | Donation match program | EGYM WellpassSenior-level Full TimeMannheim1d ago
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Artificial Intelligence | Binding Affinity Calculation | Compound design | Data Science | Drug DiscoveryChildcare support | Coaching and mentoring | Daycare centers | Flexible time off | Health checksSenior-level Full TimeWuppertal-Aprath, North Rhine Westfalia, DE2d ago
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Lead Scientist - Computational Materials Scientist – High Temperature Metallic Materials INR 2229K-3725KAlloy design | CALPHAD | Creep Life Prediction | Crystal plasticity | Diffusion modelingRelocation assistance providedSenior-level Full TimeBengaluru, India2d ago
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Diffusion Coefficient | Force Fields | GROMACS | HPC | LAMMPSRemote work | Training and mentorshipEntry-level InternshipU.S. Pacific Time (PT) Zone2d ago
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C# | C++ | Crystal plasticity | Data Analysis | Dislocation dynamics401k | Education reimbursement program | Flexible benefits package | Flexible schedules | Relocation assistanceEntry-level Full TimeLivermore, CA, United States2d ago
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Diffusion Coefficient | Force Field | GROMACS | HPC Job Submission | Job submissionRemote work | Training and mentorshipEntry-level InternshipU.S. Eastern Time (ET) Zone2d ago
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Coordination Number | Data pipeline | Data pipeline automation | Diffusion Coefficient | Field developmentRemote work | Training and mentorshipEntry-level InternshipChina2d ago
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Diffusion Coefficient | Diffusion Coefficient Calculation | Field development | Force Field | Force field developmentInternational team collaboration | Remote work | Training and mentorshipEntry-level InternshipSouth Korea2d ago
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Coordination Number | Diffusion Coefficient | Field development | Force Field | Force field developmentRemote work | Training and mentorshipEntry-level InternshipJapan2d ago
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Artificial Intelligence | Benchmarking | CUDA | Data Ingestion | Data PreprocessingThought leadership support | Training and development | Travel requiredSenior-level Full TimeUK, Remote, United Kingdom R3d ago
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C++ | Data Analysis | Dislocation Simulation | High Performance | High-Performance ComputingBenefits package | Education reimbursement | Flexible schedules | Relocation assistanceEntry-level Full TimeLivermore, CA, United States4d ago
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Senior Computational Researcher USD 78K-139KChemProp | Chemical Database Management | Chemical informatics | Database Management | High PerformanceBenefitsSenior-level Full TimeMemphis, TN, United States6d ago
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Computational Materials Scientist USD 120K-180KAI | Ab Initio | Ab-initio calculations | Density Functional Theory | Machine Learning401k | CompanyHolidays | CuttingEdgeAIResearch | FlexiblePTO | MedicalDentalVisionInsuranceSenior-level Full TimeCalifornia6d ago
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Associate Research Scientist/Research Scientist (Open Rank), Initiative for Computational Catalysis USD 130K-215KData Science | Electronic structure | Electronic structure theory | Machine Learning | Molecular DynamicsOutstanding health benefits | Support for workshops and conferencesMid-level Full Time160 5th Avenue, New York, NY …11d ago
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Ingénieur(e) en Bioinformatique EUR 48K-55KBash | C++ | Data Visualization | Database Management | DockingSenior-level Full TimeParis, France15d ago
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Bioinformatics Data Scientist EUR 70K-88KAI | Bioinformatics | Computational Biology | Data Analysis | Formulation designGlobal career mobility | Inclusive work environment | Opportunities for professional development | Sustainable chemical solutions focusMid-level Full TimeGava, B, ES, 0885016d ago
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Bayesian optimization | Computational Chemistry | Machine Learning | Materials Science | Molecular DynamicsEntry-level ContractLondon, United Kingdom16d ago
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ADME-Tox | AI workflows | AWS | Docking | FEPHealth insurance | Incentives | Paid Holidays | Profit sharing | Provident insuranceSenior-level Full TimeFrance - Toulouse - Langlade17d ago
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Computational Chemistry | Data Analysis | Machine Learning | Molecular Dynamics | ProgrammingInterdisciplinary collaboration | State-of-the-art facilitiesSenior-level Full TimeNTU Main Campus, Singapore18d ago
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Bayesian optimization | Computational Chemistry | De Novo | De novo drug design | Deep learning401k | Dental | Medical | Paid sick leave | VisionSenior-level ContractSouth San Francisco, United States18d ago
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Research Scientist Intern - Computational Biology (Seed AI-for-Science) - 2026 Start (PhD) USD 115K-237KBioinformatics | C++ | Computational Chemistry | Docking | Machine LearningHealth insurance | Life insurance | Paid Holidays | Paid sick time | Wellbeing benefitsEntry-level InternshipSeattle, Washington, United States18d ago
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Machine Learning Research Scientist - Atomistic AI USD 129K-246KComputational Chemistry | High Throughput | High-throughput computation | Machine Learning | Molecular DynamicsMid-level Full TimeSeattle, Washington, United States23d ago
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Scientist, Computational Chemistry USD 150K-215KAlchemical transformations | Amber | ChemProp | Cheminformatics | Clustering methodsCollaborative environment | Cutting-edge research | Impactful projectsSenior-level Full TimeUnited States - Remote R25d ago
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Ab Initio | Ab-initio calculations | Advanced sampling techniques | C# | C++Entry-level InternshipRedmond, WA1mo ago