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 ...
New
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 ...
New
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 ...
New
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 ...
Indianapolis, IN ยท 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 ...
Indianapolis, IN ยท 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 ...
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 ...
Livermore, CA ยท On-site
$57K - $78K/yr
... and molecular simulation workflows to address challenging problems in chemical physics and ... Develop new theoretical methods in quantum and classical molecular dynamics. * Integrate modern ...
Livermore, CA ยท On-site
$57K - $78K/yr
... and molecular simulation workflows to address challenging problems in chemical physics and ... Develop new theoretical methods in quantum and classical molecular dynamics. * Integrate modern ...
Cambridge, MA ยท 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 ...
Cambridge, MA ยท 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 ...
Livermore, CA ยท On-site
$54K - $73K/yr
... and molecular simulation workflows to address challenging problems in chemical physics and ... Develop new theoretical methods in quantum and classical molecular dynamics. * Integrate modern ...
Livermore, CA ยท On-site
$54K - $73K/yr
... and molecular simulation workflows to address challenging problems in chemical physics and ... Develop new theoretical methods in quantum and classical molecular dynamics. * Integrate modern ...
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 ...
South San Francisco, CA ยท 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 ...
South San Francisco, CA ยท 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 ...
South San Francisco, CA ยท 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 ...
South San Francisco, CA ยท 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 ...
New York, NY ยท 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 ...
New York, NY ยท 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 ...
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 ...
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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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 ...
Chapel Hill, NC ยท On-site
... and molecular dynamics simulations) is required. The successful candidate will develop a research program characterizing how genetic variants of neuroreceptors modulate medication binding and ...
Chapel Hill, NC ยท On-site
... and molecular dynamics simulations) is required. The successful candidate will develop a research program characterizing how genetic variants of neuroreceptors modulate medication binding and ...
Newark, DE ยท On-site
$47K - $65K/yr
Preference will be given to applications with expertise in 1) protein dynamics; 2) molecular dynamics simulations; and 3) high-performance computing environments. Prior programming experience is ...
Newark, DE ยท On-site
$47K - $65K/yr
Preference will be given to applications with expertise in 1) protein dynamics; 2) molecular dynamics simulations; and 3) high-performance computing environments. Prior programming experience is ...
Advances in big chemical data, massive computing power, artificial intelligence, and molecular dynamics simulations are changing the way we develop new drugs. At 1910 , we put computation at the ...
Advances in big chemical data, massive computing power, artificial intelligence, and molecular dynamics simulations are changing the way we develop new drugs. At 1910 , we put computation at the ...
Fort Collins, CO ยท On-site
Specifically, the researcher will perform molecular dynamics simulations and create machine learning models to extract information and make predictions based on biochemical data and physicochemical ...
Fort Collins, CO ยท On-site
Specifically, the researcher will perform molecular dynamics simulations and create machine learning models to extract information and make predictions based on biochemical data and physicochemical ...
$47K - $65K/yr
Preference will be given to applications with expertise in 1) protein dynamics; 2) molecular dynamics simulations; and 3) high-performance computing environments. Prior programming experience is ...
$47K - $65K/yr
Preference will be given to applications with expertise in 1) protein dynamics; 2) molecular dynamics simulations; and 3) high-performance computing environments. Prior programming experience is ...
Fort Collins, CO ยท On-site
Specifically, the researcher will perform molecular dynamics simulations and create machine learning models to extract information and make predictions based on biochemical data and physicochemical ...
Fort Collins, CO ยท On-site
Specifically, the researcher will perform molecular dynamics simulations and create machine learning models to extract information and make predictions based on biochemical data and physicochemical ...
$39K - $52.8K
0% of jobs
$52.8K - $66.5K
0% of jobs
$66.5K - $80.3K
11% of jobs
$92.5K is the 25th percentile. Wages below this are outliers.
$80.3K - $94.1K
16% of jobs
$94.1K - $107.9K
16% of jobs
The median wage is $116.8K / yr.
$107.9K - $121.6K
11% of jobs
$121.6K - $135.4K
14% of jobs
$143.2K is the 75th percentile. Wages above this are outliers.
$135.4K - $149.2K
13% of jobs
$149.2K - $163K
4% of jobs
$163K - $176.7K
13% of jobs
$176.7K - $190.5K
2% of jobs
$39K
$123.4K
$190.5K
| Aspect | Entry Level Molecular Dynamics Simulation | Entry Level Computational Chemist |
|---|---|---|
| Required Credentials | Bachelor's in Chemistry, Physics, or related field; basic knowledge of simulation software | Bachelor's in Chemistry, Chemical Engineering, or related; familiarity with computational tools |
| Work Environment | Research labs, academic institutions, industry R&D | Research labs, pharmaceutical companies, academic settings |
| Industry Usage | Material science, biochemistry, pharmaceuticals | Drug discovery, materials research, chemical analysis |
Both roles involve computational work in chemistry-related fields, but Molecular Dynamics Simulation focuses specifically on simulating molecular interactions over time, while Computational Chemists may perform a broader range of modeling and analysis tasks. The choice depends on your interest in dynamic simulations versus general computational chemistry applications.

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Innovation in investment and technology research demands more than just dataโit requires the seamless convergence of machine learning, computational chemistry, and biophysics and high-stakes execution. At the core of this firm, the challenge is not merely managing systems, but architecting the infrastructure that enables breakthroughs.
StaffRight Associates is sourcing for a world-class firm where computational excellence is the standard. We are seeking an elite professional to join the Machine Learning Research team. This is not a support role; it is a strategic position for a candidate who thrives in a research-intensive environment and understands that technical precision is the backbone of global-scale problem-solving.
Academic & Research PedigreeOur clientโs environment demands exceptional intellectual rigor. While academic achievements are highly valued, StaffRight Associates is specifically targeting elite candidates who possess advanced degrees (Masterโs or Ph.D.) in quantitative or STEM-related disciplines. Additionally, a strong track record of published research, hands-on academic exploration, or innovative technical contributions in high-performance computing, quantitative finance, or advanced technology sectors is highly preferred.
The MissionAs a Molecular Dynamics โ Machine Learning Researcher, you will act as a force multiplier for the team. Your mission is to eliminate systemic friction, allowing leadership to maintain an absolute focus on accelerating drug discovery, biomolecular simulation, and deep learning-driven molecular design.
You will transform abstract organizational challenges into high-impact, actionable outcomes. Working at the intersection of proprietary architecture and sophisticated algorithms, you will ensure that the firmโs technical output consistently pushes the boundaries of computational biochemistry and molecular biology.
Core Technical ObjectivesOrchestrate Systemic Workflows: Own and execute complex, high-stakes protocols to ensure seamless operational velocity for the Machine Learning Research group.
Distill Complex Data: Spearhead technical research, translating multifaceted bio-computational and structural information into precise deep learning frameworks that drive strategic decisions.
Optimize Frameworks: Validate and refine intricate technical requirements, ensuring systemic accuracy, structural modeling fidelity, and operational resilience.
Engineer Multi-Project Solutions: Navigate concurrent projects using a proactive Goal-Execution-Mapping (GEM) approach to preempt bottlenecks across modeling, validation, and supercomputer deployment.
Facilitate Elite Communication: Serve as a key interface between the technical/scientific committee and critical stakeholders, upholding the highest standards of professional discretion.
Architectural Mindset: You approach complex deep learning and biophysical problems with a focus on scale, efficiency, and resilience, executing with autonomous precision under pressure.
Proactive Problem-Solving: You don''''''''t just react to issues; you anticipate systemic model bottlenecks (e.g., in protein folding, generative chemistry, or force field accuracy) and resolve them before they impact the research pipeline.
Communication Precision: You translate complex technical conceptsโsuch as neural network architectures, quantum chemistry models, or molecular dynamics trajectoriesโinto clear, articulate insights for elite scientific and business minds.
Cross-Functional Agility: You pivot effortlessly between rigorous, hands-on python development and deep scientific inquiry, maintaining momentum in a high-performance ecosystem.
This is a unique opportunity to collaborate with world-class chemists, biologists, and computer scientists to expand the groupโs efforts applying machine learning to drug discovery, biomolecular simulation, and biophysics.
What You Will DoDevelop advanced deep learning techniques applied to molecular systems.
Contribute to a rapidly growing ML research effort that has already successfully published neural networks improving quantum chemistry model accuracy and trained deep learning models to generate optimized molecules for drug discovery.
Work alongside specialized, proprietary technologyโincluding multiple generations of the special-purpose supercomputer, which executes molecular dynamics simulations orders of magnitude faster than conventional systems.
Strong Programming Skills: Outstanding Python programming abilities are a baseline requirement.
Domain Alignment: Experience in molecular dynamics, structural biology, medicinal chemistry, cheminformatics, and/or quantum chemistry is highly preferred.
Note: Specific knowledge of all these domains is less critical than intellectual curiosity, versatility, and a proven track record of achievement and innovation in the broader field of machine learning.
Collaborative Mindset: A desire to contribute to a stimulating, positive, and deeply collaborative research culture.
At StaffRight Associates, we operate at the nexus of technical alignment and structural execution. We do more than match resumes to keywords; we map your specific engineering DNA to the most demanding challenges in the industry.
When you partner with us, you are collaborating with an elite team that understands the nuances of high-stakes innovation. We are committed to placing talent where their contributions drive meaningful, systemic impact.
Sourced by ZipRecruiter
Recruiting and staffing services
11 - 50 Employees
Boston, MA, US
2016