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Full Time Computational Chemistry Phd Jobs (NOW HIRING)

Iambic Therapeutics, Inc

$124K - $172K/yr

PhD or equivalent degree in computational chemistry (or related field) with 2+ years of relevant experience in drug discovery * Experience supporting active small molecule drug discovery programs

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Full Time Computational Chemistry Phd information

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$50.5K

$111.3K

$137.5K

How much do full time computational chemistry phd jobs pay per year?

As of Aug 31, 2026, the average yearly pay for full time computational chemistry phd in the United States is $111,343.00, according to ZipRecruiter salary data. Most workers in this role earn between $94,500.00 and $137,000.00 per year, depending on experience, location, and employer.

What is a full time computational chemistry PhD?

A Full Time Computational Chemistry PhD refers to someone who has earned a doctoral degree in computational chemistry and is employed in a full-time position. These professionals use computer simulations, mathematical models, and theoretical methods to study chemical systems and solve complex problems in chemistry. They often work in academic, industrial, or government research settings, focusing on areas such as drug discovery, material science, or molecular modeling. The role typically involves extensive research, data analysis, and collaboration with experimental chemists.

What types of projects and collaborations can a full time computational chemistry PhD expect to work on within a typical research team?

As a Full Time Computational Chemistry PhD, you will often participate in multidisciplinary projects that involve close collaboration with experimental chemists, biologists, and data scientists. Your daily responsibilities may include developing and running simulations, analyzing molecular interactions, and contributing to the design of new compounds or materials. You may also be involved in presenting findings at team meetings and co-authoring research papers. The collaborative nature of the role provides opportunities to expand your expertise and take on leadership roles in larger research initiatives.

What are the key skills and qualifications needed to thrive as a full time computational chemistry PhD, and why are they important?

To thrive as a Full Time Computational Chemistry PhD, you need a doctoral degree in chemistry or a related field with expertise in quantum chemistry, molecular modeling, and data analysis. Proficiency in computational tools like Gaussian, Schrödinger Suite, AMBER, and programming languages such as Python or C++ is typically required. Strong analytical thinking, problem-solving skills, and the ability to communicate complex results clearly are essential soft skills. These competencies enable the design and interpretation of simulations, collaboration with interdisciplinary teams, and advancement of research goals in academic or industry settings.

What is the difference between Full Time Computational Chemistry Phd vs Computational Chemist?

AspectFull Time Computational Chemistry PhdComputational Chemist
Required CredentialsPhD in Chemistry, Computational Chemistry, or related fieldBachelor's or Master's in Chemistry, Computational Chemistry, or related field
Work EnvironmentResearch labs, academia, industry R&DIndustry labs, pharmaceutical companies, research institutions
Employer & Industry UsageAcademic institutions, government agencies, industry research teamsPrivate sector companies, biotech, pharma, chemical industries

The Full Time Computational Chemistry Phd typically involves advanced research, academic roles, or high-level industry R&D, requiring a doctoral degree. In contrast, a Computational Chemist may hold a bachelor's or master's degree and focus on applying computational methods in industry settings. Both roles involve similar skills but differ mainly in educational requirements and work scope.

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What are the most commonly searched types of Computational Chemistry Phd jobs?

The most popular types of Computational Chemistry Phd jobs are:

What job categories do people searching Full Time Computational Chemistry Phd jobs look for?

The top searched job categories for Full Time Computational Chemistry Phd jobs are:

Full Time Computational Chemistry Phd jobs near you
Infographic showing various Full Time Computational Chemistry Phd job openings in the United States as of August 2026, with employment types broken down into 81% Full Time, 17% Part Time, and 2% Contract. Highlights an 74% Physical, 4% Hybrid, and 22% Remote job distribution, with an average salary of $111,343 per year, or $53.5 per hour.

Quantum Chemistry PhD - Coding Expert

New York, NY • On-site, Remote

Mercor
See more jobs at Mercorexternal

$70/hr

Full-time

Posted 5 days ago

Job description

About the job

Mercor connects elite creative and technical talent with leading AI research labs. Headquartered in San Francisco, our investors include Benchmark, General Catalyst, Peter Thiel, Adam D'Angelo, Larry Summers, and Jack Dorsey.

Position: Chemistry PhD Coding Experts
Type: Contract
Compensation: $70/hour
Location: Remote
Duration: 6 weeks
Commitment: 20+ hours/week

Role Responsibilities

  • Source material from published papers, Kaggle datasets, open-source repositories, or self-designed scenarios.
  • Write scientific prompts based on the input to challenge current AI models.
  • Build grading criteria that define correct answers for scientific tasks.
  • Calibrate tasks against frontier models, ensuring they are challenging for strong models.
  • Work independently and asynchronously to meet deadlines while improving AI model performance.

Qualifications

Must-Have

  • PhD in chemistry, physical chemistry, theoretical chemistry, computational chemistry, or a closely related field.
  • Demonstrated depth in both quantum chemistry and computational chemistry.
  • Working proficiency in Python, R, or another relevant programming language for scientific computing.
  • Comfortable with Git/GitHub and running code in Docker.

Preferred

  • Publications in peer-reviewed journals.
  • Prior scientific software or research engineering experience.

Start Date

  • Immediate

Application Process (Takes 20–30 mins to complete)

  • Upload resume and application form
  • A 25-minute conversational interview covering your background, experience, and motivations
  • Follow up within a few days with next steps and onboarding

Resources & Support

  • For details about the interview process and platform information, please check: https://talent.docs.mercor.com/welcome
  • For any help or support, reach out to: support@mercor.com

PS: Our team reviews applications daily. Please complete your AI interview and application steps to be considered for this opportunity.