... to molecular dynamics' modeling to ensure the team is delivering what the community needs. • ... simulator community. • Proven record to lead multi-functional dependencies, work across ...
... to molecular dynamics' modeling to ensure the team is delivering what the community needs. • ... simulator community. • Proven record to lead multi-functional dependencies, work across ...
Familiarity with molecular dynamics simulation concepts (force fields, electrostatics, neighbor lists, periodic boundary conditions) sufficient to engage credibly with both colleagues and the MD ...
Familiarity with molecular dynamics simulation concepts (force fields, electrostatics, neighbor lists, periodic boundary conditions) sufficient to engage credibly with both colleagues and the MD ...
Familiarity with molecular dynamics simulation concepts (force fields, electrostatics, neighbor lists, periodic boundary conditions) sufficient to engage credibly with both colleagues and the MD ...
Familiarity with molecular dynamics simulation concepts (force fields, electrostatics, neighbor lists, periodic boundary conditions) sufficient to engage credibly with both colleagues and the MD ...
The Mission As a Molecular Dynamics - Machine Learning Researcher , you will act as a force ... simulation, and deep learning-driven molecular design . You will transform abstract organizational ...
The Mission As a Molecular Dynamics - Machine Learning Researcher , you will act as a force ... simulation, and deep learning-driven molecular design . You will transform abstract organizational ...
Molecular Design & DNA Nanotechnology Lead
Emeryville, CA · On-site
$180K - $200K/yr
Use coarse-grained molecular-dynamics simulation (e.g., oxDNA) to predict the mechanism's mechanical behavior - stiffness, compliance, and thermal stability of its motion - and iterate the design.
Molecular Design & DNA Nanotechnology Lead
Emeryville, CA · On-site
$180K - $200K/yr
Use coarse-grained molecular-dynamics simulation (e.g., oxDNA) to predict the mechanism's mechanical behavior - stiffness, compliance, and thermal stability of its motion - and iterate the design.
... dynamics, enhanced sampling (metadynamics, replica exchange, umbrella sampling), and free energy ... in molecular simulation, including MD, enhanced sampling, and/or free energy methods using tools ...
... dynamics, enhanced sampling (metadynamics, replica exchange, umbrella sampling), and free energy ... in molecular simulation, including MD, enhanced sampling, and/or free energy methods using tools ...
Develop and apply simulation methods spanning molecular dynamics, enhanced sampling (metadynamics, replica exchange, umbrella sampling), and free energy calculations (FEP/TI) to support active drug ...
Develop and apply simulation methods spanning molecular dynamics, enhanced sampling (metadynamics, replica exchange, umbrella sampling), and free energy calculations (FEP/TI) to support active drug ...
Molecular Dynamics and Aerospace Engineer
Houston, TX · On-site +1
$86K - $198K/yr
As a molecular dynamics and granular mechanics simulation engineer on the Team, you will be responsible for developing particle-scale physics models that resolve contact mechanics, cohesion, and ...
Molecular Dynamics and Aerospace Engineer
Houston, TX · On-site +1
$86K - $198K/yr
As a molecular dynamics and granular mechanics simulation engineer on the Team, you will be responsible for developing particle-scale physics models that resolve contact mechanics, cohesion, and ...
Molecular Dynamics and Aerospace Engineer
$86K - $198K/yr
As a molecular dynamics and granular mechanics simulation engineer on the Team, you will be responsible for developing particle-scale physics models that resolve contact mechanics, cohesion, and ...
New
Molecular Dynamics and Aerospace Engineer
$86K - $198K/yr
As a molecular dynamics and granular mechanics simulation engineer on the Team, you will be responsible for developing particle-scale physics models that resolve contact mechanics, cohesion, and ...
New
Post-doctoral Computational Chemist, Advanced Molecular Design
Indianapolis, IN · On-site
$21 - $28.25/hr
Execute advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and protein-protein interactions in ...
Post-doctoral Computational Chemist, Advanced Molecular Design
Indianapolis, IN · On-site
$21 - $28.25/hr
Execute advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and protein-protein interactions in ...
Execute advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and protein-protein interactions in ...
Execute advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and protein-protein interactions in ...
Learn about Molecular Dynamics simulation * Write code to simulate the dynamics of self-assembly fluids * Meet with Professor once a week Qualifications: * Some prior experience with coding and ...
Learn about Molecular Dynamics simulation * Write code to simulate the dynamics of self-assembly fluids * Meet with Professor once a week Qualifications: * Some prior experience with coding and ...
Physics and Astronomy Research Work Study
Schenectady, NY · On-site
$9.70/hr
Learn about Molecular Dynamics simulation * Write code to simulate the dynamics of self-assembly fluids * Meet with Professor once a week Qualifications: * Some prior experience with coding and ...
Physics and Astronomy Research Work Study
Schenectady, NY · On-site
$9.70/hr
Learn about Molecular Dynamics simulation * Write code to simulate the dynamics of self-assembly fluids * Meet with Professor once a week Qualifications: * Some prior experience with coding and ...
Senior Software Engineer -- MD Simulation Engineering
Santa Clara, CA · On-site
$143K - $189K/yr
... molecular dynamics simulation concepts • Experience building or supplying to scientific software libraries, simulation engines, or developer-facing GPU APIs. • BS/MS in Computer Science ...
Senior Software Engineer -- MD Simulation Engineering
Santa Clara, CA · On-site
$143K - $189K/yr
... molecular dynamics simulation concepts • Experience building or supplying to scientific software libraries, simulation engines, or developer-facing GPU APIs. • BS/MS in Computer Science ...
Senior Software Engineer - MD Simulation Engineering
Santa Clara, CA · On-site
$143K - $189K/yr
This team builds the GPU-native simulation software that powers molecular dynamics at scale. We work at the intersection of GPU computing and computational biology - delivering high-performance math ...
Senior Software Engineer - MD Simulation Engineering
Santa Clara, CA · On-site
$143K - $189K/yr
This team builds the GPU-native simulation software that powers molecular dynamics at scale. We work at the intersection of GPU computing and computational biology - delivering high-performance math ...
This team builds the GPU-native simulation software that powers molecular dynamics at scale. We work at the intersection of GPU computing and computational biology - delivering high-performance math ...
This team builds the GPU-native simulation software that powers molecular dynamics at scale. We work at the intersection of GPU computing and computational biology - delivering high-performance math ...
Integrate experimental data with advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and ...
Integrate experimental data with advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and ...
Advances in big chemical data, massive computing power, artificial intelligence, and molecular dynamics simulation are changing the way we develop new drugs. At 1910 , we put computation at the heart ...
Advances in big chemical data, massive computing power, artificial intelligence, and molecular dynamics simulation are changing the way we develop new drugs. At 1910 , we put computation at the heart ...
Integrate experimental data with advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and ...
Integrate experimental data with advanced quantum mechanical calculations, molecular dynamics simulations and free energy calculations to study protein motion, protein-ligand interactions, and ...
Advances in big chemical data, massive computing power, artificial intelligence, and molecular dynamics simulation are changing the way we develop new drugs. At 1910 , we put computation at the heart ...
Advances in big chemical data, massive computing power, artificial intelligence, and molecular dynamics simulation are changing the way we develop new drugs. At 1910 , we put computation at the heart ...
Molecular Dynamics Simulation Internship information
See salary details
$8.65 - $9.86
2% of jobs
$9.86 - $11.06
4% of jobs
$11.06 - $12.26
14% of jobs
$12.72 is the 25th percentile. Wages below this are outliers.
$12.26 - $13.46
12% of jobs
$13.46 - $14.66
15% of jobs
The median wage is $14.84 / hr.
$14.66 - $15.87
18% of jobs
$17.03 is the 75th percentile. Wages above this are outliers.
$15.87 - $17.07
10% of jobs
$17.07 - $18.27
6% of jobs
$18.27 - $19.47
8% of jobs
$19.47 - $20.67
5% of jobs
$20.67 - $21.87
5% of jobs
$8
$15
$21
How much do molecular dynamics simulation internship jobs pay per hour?
As of Aug 4, 2026, the average hourly pay for molecular dynamics simulation internship in the United States is $15.54, according to ZipRecruiter salary data. Most workers in this role earn between $12.50 and $17.55 per hour, depending on experience, location, and employer.
What are the typical responsibilities of a molecular dynamics simulation intern?
As a Molecular Dynamics Simulation Intern, your typical responsibilities may include assisting with setting up and running simulations, analyzing molecular behavior and data, and contributing to the development or optimization of simulation protocols. You will often work closely with senior researchers or computational scientists, participate in project meetings, and document your findings. Interns may also be tasked with troubleshooting code, keeping up with scientific literature, and preparing presentations or reports on their work. This hands-on experience helps you develop key technical and collaborative skills valued in both industry and research careers.
What are the key skills and qualifications needed for a molecular dynamics simulation internship?
To thrive as a Molecular Dynamics Simulation Intern, you need a solid foundation in chemistry, physics, and computational modeling, typically supported by progress toward a degree in a related field. Familiarity with simulation software such as GROMACS, AMBER, or LAMMPS, along with programming skills in Python or C++, is often required. Strong analytical thinking, attention to detail, and effective teamwork and communication skills help you excel in a collaborative research environment. These competencies enable interns to contribute meaningfully to complex simulation projects, interpret results accurately, and work efficiently within multidisciplinary teams.
What is a molecular dynamics simulation internship?
A Molecular Dynamics Simulation Internship involves using computational techniques to model and analyze the behavior of molecules over time. Interns typically work with software tools like GROMACS, LAMMPS, or AMBER to simulate physical movements of atoms and molecules. These simulations help researchers understand properties such as protein folding, material behavior, or drug interactions. Interns often analyze data, optimize simulation parameters, and may assist in writing reports or research papers. This role is ideal for students with a background in chemistry, physics, bioinformatics, or related fields.
More about Molecular Dynamics Simulation Internship jobs
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What are the most commonly searched types of Molecular Dynamics Simulation jobs? The most popular types of Molecular Dynamics Simulation jobs are:
What states have the most Molecular Dynamics Simulation Internship jobs? States with the most job openings for Molecular Dynamics Simulation Internship jobs include:
What job categories do people searching Molecular Dynamics Simulation Internship jobs look for? The top searched job categories for Molecular Dynamics Simulation Internship jobs are:
Full-time
Re-posted 14 days ago
Nvidia rating
9.6
Based on 17 frontline employees who took The Breakroom Quiz
8th of 241 rated software companies
Job description
Job Summary:
NVIDIA is a leader in computer graphics and AI technology, seeking a hands-on technical manager for their MD Simulation Engineering team. The role involves leading engineers to develop GPU-native simulation software and collaborating with the scientific community to enhance biological simulations.
Responsibilities:
• Lead, hire, and develop software engineers within a collaborative unit; build a culture of ownership, engineering excellence, and direct collaboration with researchers and authorities in the field.
• Define vision, strategy, and roadmap for the division's GPU-accelerated simulation software.
• Own end-to-end delivery across multiple workstreams; align partners, lead cross-team dependencies, and drive predictable execution.
• Partner with Applied Science teams to translate research prototypes into production-quality, benchmarked software.
• Build and maintain relationships with the community dedicated to molecular dynamics' modeling to ensure the team is delivering what the community needs.
• Drive engineering completion: code quality, CI/CD, multi-SKU validation, and documentation standards.
• Communicate progress, risks, and decisions clearly.
Qualifications:
Required:
• 8+ overall years of software engineering experience, including 3+ years being responsible for an engineering team with direct reports.
• Strong technical foundation in GPU computing and high-performance scientific software; ability to review builds, influence architectural directions, and maintain a high engineering standard across the team's work.
• Experience shipping production GPU libraries, scientific computing software, or developer-facing APIs — you understand what it takes to go from prototype to a product that external developers depend on.
• Familiarity with molecular dynamics simulation concepts (force fields, electrostatics, neighbor lists, periodic boundary conditions) sufficient to engage credibly with both colleagues and the MD simulator community.
• Proven record to lead multi-functional dependencies, work across interpersonal boundaries without direct authority, and communicate technical progress clearly to senior leadership.
• BS/MS in Computer Science, Computational Science, Physics, Chemistry, or a related field, or equivalent experience.
Preferred:
• You have shipped a GPU-accelerated scientific computing library or supplied to a major open-source MD simulation engine.
• PhD-level education or comparable experience in computational chemistry, biophysics, applied mathematics, or computer science with a focus on HPC or scientific computing.
• Experience with GPU compiler toolchains or kernel delivery mechanisms.
• You have worked across the boundary between applied science and engineering — taking algorithmic research and turning it into a shipped, benchmarked product.
• Active engagement in the MD simulation or computational chemistry community through publications, conference talks, or open-source contributions.
Company:
NVIDIA is a computing platform company operating at the intersection of graphics, HPC, and AI. Founded in 1993, the company is headquartered in Santa Clara, USA, with a team of 10001+ employees. The company is currently Late Stage.
NVIDIA is a leader in computer graphics and AI technology, seeking a hands-on technical manager for their MD Simulation Engineering team. The role involves leading engineers to develop GPU-native simulation software and collaborating with the scientific community to enhance biological simulations.
Responsibilities:
• Lead, hire, and develop software engineers within a collaborative unit; build a culture of ownership, engineering excellence, and direct collaboration with researchers and authorities in the field.
• Define vision, strategy, and roadmap for the division's GPU-accelerated simulation software.
• Own end-to-end delivery across multiple workstreams; align partners, lead cross-team dependencies, and drive predictable execution.
• Partner with Applied Science teams to translate research prototypes into production-quality, benchmarked software.
• Build and maintain relationships with the community dedicated to molecular dynamics' modeling to ensure the team is delivering what the community needs.
• Drive engineering completion: code quality, CI/CD, multi-SKU validation, and documentation standards.
• Communicate progress, risks, and decisions clearly.
Qualifications:
Required:
• 8+ overall years of software engineering experience, including 3+ years being responsible for an engineering team with direct reports.
• Strong technical foundation in GPU computing and high-performance scientific software; ability to review builds, influence architectural directions, and maintain a high engineering standard across the team's work.
• Experience shipping production GPU libraries, scientific computing software, or developer-facing APIs — you understand what it takes to go from prototype to a product that external developers depend on.
• Familiarity with molecular dynamics simulation concepts (force fields, electrostatics, neighbor lists, periodic boundary conditions) sufficient to engage credibly with both colleagues and the MD simulator community.
• Proven record to lead multi-functional dependencies, work across interpersonal boundaries without direct authority, and communicate technical progress clearly to senior leadership.
• BS/MS in Computer Science, Computational Science, Physics, Chemistry, or a related field, or equivalent experience.
Preferred:
• You have shipped a GPU-accelerated scientific computing library or supplied to a major open-source MD simulation engine.
• PhD-level education or comparable experience in computational chemistry, biophysics, applied mathematics, or computer science with a focus on HPC or scientific computing.
• Experience with GPU compiler toolchains or kernel delivery mechanisms.
• You have worked across the boundary between applied science and engineering — taking algorithmic research and turning it into a shipped, benchmarked product.
• Active engagement in the MD simulation or computational chemistry community through publications, conference talks, or open-source contributions.
Company:
NVIDIA is a computing platform company operating at the intersection of graphics, HPC, and AI. Founded in 1993, the company is headquartered in Santa Clara, USA, with a team of 10001+ employees. The company is currently Late Stage.
About Nvidia
Sourced by ZipRecruiter
NVIDIA has been transforming computer graphics, PC gaming, and accelerated computing for more than 25 years. It's a unique legacy of innovation that's fueled by great technology--and amazing people. Today, we're tapping into the unlimited potential of AI to define the next era of computing. An era in which our GPU acts as the brains of computers, robots, and self-driving cars that can understand the world. Doing what's never been done before takes vision, innovation, and the world's best talent.
Industry
Computer and electronic product manufacturing
Company size
10,000+ Employees
Headquarters location
Santa Clara, CA, US
Year founded
1993