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Molecular Dynamics Internship Jobs (NOW HIRING)

Zymo Research

Research Intern Sample Prep

Tustin, CA · On-site

$20/hr

Job Title Zymo Research is looking for a dynamic individual to join our sample prep team. This is ... This position is a part-time internship (maximum of 29 hours per week). Essential Duties and ...

Bio-Techne

Scientist, Probe Design

Newark, CA

$89K - $146K/yr

  • Medical

  • Dental

  • Vision

  • Life

  • Retirement

  • PTO

... of molecular pathology and tissue-based diagnostics. Our core RNAscope technology is the world ... The Scientist will work within a highly dynamic group to develop and optimize new probe products ...

Frontage Laboratories

Associate Scientist

Exton, PA · On-site

  • Medical

  • Dental

  • Life

  • Retirement

Bachelor's or master's degree in Biochemistry, Molecular Biology, Immunology, Pharmaceutical ... Opportunity for career growth within a dynamic and fast-paced research environment. If you are ...

Inceptive

Leading Data-Driven Lab for AI Medicines

Palo Alto, CA · On-site

$245K - $305K/yr

  • Medical

  • Retirement

  • PTO

... dynamic environment. You will also interface closely with our AI team to maximize the impact of ... Deep understanding of theory, techniques, and experimental design in molecular and cellular biology

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Molecular Dynamics Internship information

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How much do molecular dynamics internship jobs pay per hour?

As of Aug 15, 2026, the average hourly pay for molecular dynamics 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 key skills and qualifications needed to thrive in a molecular dynamics internship, and why are they important?

To thrive as a Molecular Dynamics Intern, a strong background in chemistry, physics, or computational science, combined with coursework in molecular modeling and simulation, is essential. Familiarity with molecular dynamics software packages (such as GROMACS or AMBER), programming languages like Python or C++, and data analysis tools is highly valued. Strong problem-solving abilities, attention to detail, and effective communication skills help interns excel when collaborating with multidisciplinary teams. These skills ensure meaningful contributions to research projects and successful navigation of the technical challenges inherent in molecular simulation studies.

What kind of projects and responsibilities can I expect during a molecular dynamics internship?

As a Molecular Dynamics Intern, you will typically work on projects involving running and analyzing simulations of biological molecules or materials, often under the guidance of experienced researchers. Your daily tasks may include setting up simulation systems, writing and modifying scripts, processing simulation results, and presenting your findings at team meetings. You'll likely collaborate with computational scientists, chemists, and other interns, gaining exposure to both theory and hands-on research. This role is a great opportunity to develop technical skills, contribute to meaningful scientific advancements, and build professional relationships within the research community.

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Molecular Dynamics Internship jobs near you
Infographic showing various Molecular Dynamics Internship job openings in the United States as of August 2026, with employment types broken down into 12% Internship, 63% Full Time, 22% Part Time, 1% Temporary, and 2% Contract. Highlights an 87% Physical, 2% Hybrid, and 11% Remote job distribution, with an average salary of $32,333 per year, or $15.5 per hour.

Consultant Scientist, Computer Aided Drug Design (CADD)

Psivant Therapeutics, Inc.

Watertown, MA

$150K - $185K/yr

Contractor

Posted 11 days ago

Job description

PsiThera is seeking a consultant computational medicinal chemist with expertise in drug discovery, molecular simulations and AI/ML to join our dynamic, multidisciplinary team.  Our science, our team, and our mission are focused on applying advanced computational technologies to progress a pipeline of innovative medicines for patients.  We are looking for a self-motivated individual who thrives in a fast-paced, highly collaborative environment that integrates computational and wet lab capabilities to drive our programs to the clinic.  The ideal candidate will utilize advanced computational strategies across all stages of drug discovery, including hit identification, hit-to-lead and lead optimization.  In addition, a successful candidate will have a demonstrable pharma/biotech industry record using computational methods to advance drug discovery projects, analyze simulation and AI/ML results, derive actionable hypotheses and effectively communicate findings to the team.  This individual will report to the Senior Director of CADD and collaborate closely across functions including experimental medicinal chemistry, structural biology, and application engineering teams to provide actionable insights and strategic guidance.
Key Responsibilities
  • Design small molecule (and related modality) therapeutics using structural/simulation/ML/assay data, ensuring alignment with the requirements and timelines of our drug discovery projects, and leading computational analysis and design activities on cross-functional projects.
  • Integrate knowledge of relevant computational tools and approaches, as well as key aspects of medicinal chemistry and compound property optimization, for all project stages from target selection and druggability analysis to clinical candidate nomination.
  • Collaborate with the computational development team to align priorities between platform application development and R&D projects.
  • Develop modifications and drive improvements in internal applications, building on our internal physics-based simulation capabilities and assessment of fidelity and accuracy of calculations.
  • Train and mentor team members across the organization to build understanding of modeling and AI/ML concepts and how they address project team needs.
Requirements
  • PhD in computational chemistry, organic or physical chemistry, physics, or a closely related field
  • Minimum of 5 years computer-aided drug design (CADD) or related biotech/pharma experience, with expertise accelerating small molecule drug discovery projects from target tractability and hit identification, through lead optimization (demonstrated by peer reviewed publications and inventorship status on patent applications)
  • Demonstrated experience and understanding of physics-based, AI/ML, and generative computational approaches to drug discovery
  • Excellent communication and collaboration skills, with the ability to work well in a multidisciplinary environment
  • Excellent organizational skills and attention to detail, with a strong passion for learning new concepts and technologies
Additional Qualifications
  • Proficiency in scientific programming (e.g. Python, R, C++)
  • Proficiency in molecular simulation packages (e.g. AMBER, OpenMM, NAMD, Gromacs)
  • Proficiency in data science and machine learning tools (e.g. scikit-learn, pytorch)
  • Experience mentoring interns, co-ops, and junior scientists
About PsiThera
PsiThera is creating better therapeutics through an integrated molecular design paradigm that leverages best-in-class physics-based and AI technologies honed through decades of research and innovation.  Our focus is first-in-class inflammation and immunology (I&I) small molecule therapeutics. We have assembled a diverse team with extensive experience across disciplines ranging from physics and computer science to chemistry, biology, biochemistry, and structural biology.  This continuum of complementary skills drives our scientific vision to deliver meaningful therapeutics to patients in need.  We are patient-inspired, perseverant, synergistic, supportive, intrepid, and inclusive.  If you’re passionate about advancing medicine in a fast-paced, innovative environment, and eager to contribute to a team that blends advanced computation with drug discovery, Psivant might be the perfect fit for you.
 
At PsiThera, we are a lean, high-performing team dedicated to pushing boundaries and achieving growth—both personally and scientifically.  We seek individuals who are smart, collaborative, and thrive in a dynamic, early-stage biotech environment.
 
Read More About Us
·       Our Story:            Company - PsiThera
·       Team:                    Team and Leadership - Company - PsiThera
 
PsiThera is proud to be an Equal Opportunity Employer, committed to fostering an inclusive and diverse workplace. We comply with all applicable laws and regulations, ensuring that all qualified applicants receive consideration for employment without regard to race, color, religion, gender, sexual orientation, gender identity or expression, national origin, age, disability, veteran status, genetic information, or any other legally protected status.
 
Please note that we do not accept unsolicited resumes and kindly request that recruiters do not contact our team regarding this job posting. If a resume is submitted without a prior agreement, we will not be obligated to pay any referral or placement fees. Thank you for your understanding!
 

We may use artificial intelligence (AI) tools to support parts of the hiring process, such as reviewing applications, analyzing resumes, or assessing responses and identifying potential inconsistencies or verification signals in application materials based on available information. These tools assist our recruitment team but do not replace human judgment. Final hiring decisions are ultimately made by humans. If you would like more information about how your data is processed, please contact us.