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 ...
Demonstrated expertise with molecular dynamics, Monte Carlo, and/or kinetic simulation software and frameworks (LAMMPS, GROMACS, OpenMM, HOOMD, etc.). * Solid programming skills and experience with ...
Demonstrated expertise with molecular dynamics, Monte Carlo, and/or kinetic simulation software and frameworks (LAMMPS, GROMACS, OpenMM, HOOMD, etc.). * Solid programming skills and experience with ...
Research Scientist I/II, Statistical Mechanics and Dynamics
Cambridge, MA · On-site
$176K - $234K/yr
Demonstrated expertise with molecular dynamics, Monte Carlo, and/or kinetic simulation software and frameworks (LAMMPS, GROMACS, OpenMM, HOOMD, etc.). * Solid programming skills and experience with ...
Research Scientist I/II, Statistical Mechanics and Dynamics
Cambridge, MA · On-site
$176K - $234K/yr
Demonstrated expertise with molecular dynamics, Monte Carlo, and/or kinetic simulation software and frameworks (LAMMPS, GROMACS, OpenMM, HOOMD, etc.). * Solid programming skills and experience with ...
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 ...
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 ...
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 ...
Perform molecular dynamics simulations of chemically modified oligonucleotide duplexes and single-stranded species to characterize the structural and thermodynamic consequences of sugar, backbone ...
Perform molecular dynamics simulations of chemically modified oligonucleotide duplexes and single-stranded species to characterize the structural and thermodynamic consequences of sugar, backbone ...
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Required : • PhD (or equivalent experience) in computational chemistry, chemistry, or related field with 0 - 5 years relevant experience • Knowledge of molecular dynamics simulations, binding ...
Required : • PhD (or equivalent experience) in computational chemistry, chemistry, or related field with 0 - 5 years relevant experience • Knowledge of molecular dynamics simulations, binding ...
Ph.d StudentResearcher Stipend
New York, NY · On-site
$48K/yr
The evaluation of the lead targets will be performed by running Molecular Dynamic Simulation to test how it's affecting the function of the ion channel in terms of ion conductance or ion influx. The ...
Ph.d StudentResearcher Stipend
New York, NY · On-site
$48K/yr
The evaluation of the lead targets will be performed by running Molecular Dynamic Simulation to test how it's affecting the function of the ion channel in terms of ion conductance or ion influx. The ...
Our unique focus on physics-based simulations, specifically Molecular Dynamics, allows us to help develop and deliver better medicines by reducing problem spaces even in the absence of sizable ...
Our unique focus on physics-based simulations, specifically Molecular Dynamics, allows us to help develop and deliver better medicines by reducing problem spaces even in the absence of sizable ...
Technical Development Principal Scientist - Computational Biophysics
South San Francisco, CA · On-site
$120K - $224K/yr
Our unique focus on physics-based simulations, specifically Molecular Dynamics, allows us to help develop and deliver better medicines by reducing problem spaces even in the absence of sizable ...
Technical Development Principal Scientist - Computational Biophysics
South San Francisco, CA · On-site
$120K - $224K/yr
Our unique focus on physics-based simulations, specifically Molecular Dynamics, allows us to help develop and deliver better medicines by reducing problem spaces even in the absence of sizable ...
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
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 ...
Postdoctoral Research Associate, Atomistic Simulations & AI-Driven Molecular Modeling
Oak Ridge, TN · On-site
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Postdoctoral Research Associate, Atomistic Simulations & AI-Driven Molecular Modeling
Oak Ridge, TN · On-site
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Experience with first-principles, molecular dynamics, or surface reaction modeling * Exposure to feature-scale or device-relevant plasma simulations * Familiarity with multi-physics coupling and ...
Experience with first-principles, molecular dynamics, or surface reaction modeling * Exposure to feature-scale or device-relevant plasma simulations * Familiarity with multi-physics coupling and ...
AI Engineer - AI+CryoET
Ashburn, VA · On-site
This role is part of the AI+CryoET project within AI@HHMI, a multi-institutional project at the intersection of cryo-electron tomography (cryoET), molecular dynamics simulation, and machine learning.
AI Engineer - AI+CryoET
Ashburn, VA · On-site
This role is part of the AI+CryoET project within AI@HHMI, a multi-institutional project at the intersection of cryo-electron tomography (cryoET), molecular dynamics simulation, and machine learning.
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Develop and apply scalable molecular dynamics (MD) and multiscale simulation workflows for biomolecular systems (proteins, enzymes, membranes, and complexes) * Integrate AI/ML approaches with physics ...
Temporary Molecular Dynamics Simulation information
See salary details
$11K - $19.4K
0% of jobs
$19.4K - $27.8K
0% of jobs
$27.8K - $36.2K
0% of jobs
$36.2K - $44.6K
0% of jobs
$44.6K - $53K
0% of jobs
$53K - $61.5K
0% of jobs
$65.5K is the 25th percentile. Wages below this are outliers.
$61.5K - $69.9K
52% of jobs
$69.9K - $78.3K
15% of jobs
$78.3K - $86.7K
0% of jobs
$86.7K - $95.1K
1% of jobs
$96.9K is the 75th percentile. Wages above this are outliers.
$95.1K - $103.5K
32% of jobs
$11K
$80.7K
$103.5K
How much do temporary molecular dynamics simulation jobs pay per year?
What is a Temporary Molecular Dynamics Simulation job?
What are some typical challenges faced when working on temporary molecular dynamics simulation projects?
What are the key skills and qualifications needed to thrive as a Molecular Dynamics Simulation Specialist, and why are they important?
What is the difference between Temporary Molecular Dynamics Simulation vs Computational Chemist?
| Aspect | Temporary Molecular Dynamics Simulation | Computational Chemist |
|---|---|---|
| Required Credentials | Bachelor's or Master's in Chemistry, Physics, or related field; experience with simulation software | Degree in Chemistry, Chemical Engineering, or related; proficiency in computational tools |
| Work Environment | Research labs, academic institutions, industry R&D | Research labs, pharmaceutical companies, academia |
| Industry Usage | Used for modeling molecular behavior over short periods | Broader role including modeling, data analysis, and interpretation |
| Common Search/Comparison | Often compared for job scope and skills required | Related but broader in scope |
Temporary Molecular Dynamics Simulation focuses on short-term modeling of molecular systems, often using specialized software. Computational Chemist has a broader role involving various computational techniques to analyze chemical systems. Both roles require similar educational backgrounds and work environments, but their scope and application differ.

Full-time
Posted 18 days ago
Job description
NVIDIA BioNeMo is building the computational foundation for the next generation of biological discovery. We are looking for a hands-on technical manager to lead our MD Simulation Engineering team - a focused group whose mission is to enable biological simulation engines at scale.
You will lead a team of engineers building the GPU-native simulation software the scientific community depends on. This role combines player and mentor responsibilities. You will maintain technical credibility throughout the group's efforts and guide architectural decisions. You also be responsible for the roadmap, coordinate dependencies with NVIDIA and external partners, and support team growth.
What You'll Be Doing:
- 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.
What We Need to See:
- 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.
Ways to Stand Out from the Crowd:
- 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.
Widely considered to be one of the technology world's most desirable employers, NVIDIA offers highly competitive salaries and a comprehensive benefits package. As you plan your future, see what we can offer to you and your family www.nvidiabenefits.com/
Your base salary will be determined based on your location, experience, and the pay of employees in similar positions. The base salary range is 224,000 USD - 356,500 USD.
You will also be eligible for equity and benefits.
Applications for this job will be accepted at least until May 26, 2026.
This posting is for an existing vacancy.
NVIDIA uses AI tools in its recruiting processes.
NVIDIA is committed to fostering a diverse work environment and proud to be an equal opportunity employer. As we highly value diversity in our current and future employees, we do not discriminate (including in our hiring and promotion practices) on the basis of race, religion, color, national origin, gender, gender expression, sexual orientation, age, marital status, veteran status, disability status or any other characteristic protected by law.
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