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Freelance Molecular Dynamics Simulation Jobs (NOW HIRING)

1910

Computational Theoretical Chemist II

Boston, MA

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 ...

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Freelance Molecular Dynamics Simulation information

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How much do freelance molecular dynamics simulation jobs pay per hour?

As of Jul 26, 2026, the average hourly pay for freelance molecular dynamics simulation in the United States is $62.54, according to ZipRecruiter salary data. Most workers in this role earn between $60.34 and $68.27 per hour, depending on experience, location, and employer.

What are the key skills and qualifications needed to thrive as a Freelance Molecular Dynamics Simulation specialist, and why are they important?

To thrive as a Freelance Molecular Dynamics Simulation specialist, you need a solid background in physics, chemistry, or related fields, along with expertise in computational modeling and simulation methods. Proficiency with simulation software such as GROMACS, AMBER, or LAMMPS, and experience with programming languages like Python or C++, are typically required. Strong problem-solving skills, attention to detail, and effective communication are important soft skills for collaborating with clients and interpreting complex data. These abilities are crucial for delivering accurate, reliable results and building a successful freelance reputation in a technical, research-driven environment.

What is the difference between Freelance Molecular Dynamics Simulation vs Freelance Computational Chemist?

AspectFreelance Molecular Dynamics SimulationFreelance Computational Chemist
CredentialsKnowledge of molecular dynamics software, basic chemistry backgroundAdvanced chemistry education, experience with computational modeling
Work EnvironmentRemote, project-based, often collaborative with research teamsRemote or lab-based, research-focused projects
Industry UsagePharmaceuticals, materials science, biochemistryPharmaceuticals, chemical industry, academia
Search & ComparisonOften compared for specialized computational roles in molecular modelingBroader computational chemistry roles, less specialized

Freelance Molecular Dynamics Simulation focuses on simulating molecular interactions using specialized software, often requiring knowledge of physics and chemistry. Freelance Computational Chemist covers a broader range of computational modeling techniques in chemistry. While both roles involve remote work and scientific expertise, Molecular Dynamics Simulation is more specialized in dynamic simulations, whereas Computational Chemist may include various modeling approaches.

What are some common challenges faced by freelance molecular dynamics simulation professionals when working with clients from diverse scientific backgrounds?

Freelance molecular dynamics simulation professionals often collaborate with clients from a range of scientific disciplines, such as chemistry, biology, or materials science. One common challenge is effectively communicating complex simulation concepts and results to clients who may not have a deep computational background. Additionally, freelancers must adapt simulation protocols to fit specific client needs, project goals, and timelines, which can vary widely. Successful professionals are proactive in clarifying objectives, managing expectations, and providing clear, actionable data interpretations to ensure project success.

What does a Freelance Molecular Dynamics Simulation specialist do?

A Freelance Molecular Dynamics Simulation specialist uses computational techniques to model and analyze the physical movements of atoms and molecules. They help researchers and companies understand molecular interactions, predict material properties, or optimize drug designs by running simulations and interpreting the results. Their work often involves setting up simulations, customizing parameters, and using specialized software to generate insights for various scientific or engineering projects.
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What cities are hiring for Freelance Molecular Dynamics Simulation jobs? Cities with the most Freelance Molecular Dynamics Simulation job openings:
What are the most commonly searched types of Molecular Dynamics Simulation jobs? The most popular types of Molecular Dynamics Simulation jobs are:
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Freelance Molecular Dynamics Simulation jobs near you
Infographic showing various Freelance Molecular Dynamics Simulation job openings in the United States as of July 2026, with employment types broken down into 70% Full Time, 13% Part Time, 4% Temporary, and 13% Contract. Highlights an 96% In-person, and 4% Remote job distribution, with an average salary of $130,079 per year, or $62.5 per hour.
Manager, Molecular Simulation Engineering

Manager, Molecular Simulation Engineering

NVIDIA

Santa Clara, CA • On-site

Full-time

Posted 5 days ago

Nvidia rating

9.6

Company rating: 9.6 out of 10

Based on 17 frontline employees who took The Breakroom Quiz

8th of 245 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.

What Nvidia employees say

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Benefits

Hours and flexibility

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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

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