Sign up to access all features of our service.
  • Job search
  • Favorites
  • Create a CV
    New
  • Salaries
  • Subscriptions

Assistant Principal Scientist, Computational Chemistry

Insmed

Insmed seeks an experienced computational chemist to serve as senior technical authority for physics-based drug discovery tools. The role involves providing hands-on computational support across small molecule programs from hit identification through lead optimization, collaborating with medicinal chemistry and structural biology teams.

Responsibilities

  • Serve as senior technical expert providing hands-on computational support across multiple small molecule discovery programs
  • Generate and test scientific hypotheses that inform compound design and project strategy decisions
  • Apply advanced computational methods including docking, MD, free energy, and QM to guide medicinal chemistry
  • Collaborate with medicinal chemists, structural biologists, and DMPK teams to address multi-parameter optimization challenges
  • Evaluate and lead adoption of emerging computational methodologies to improve scientific productivity

Requirements

  • PhD in computational chemistry, chemistry, chemical physics, biophysics, or related discipline
  • 8+ years post-PhD industrial experience in computational chemistry for small molecule drug discovery
  • Deep expertise in physics-based methods: docking, molecular dynamics, free energy calculations, QM, water thermodynamics
  • Strong understanding of medicinal chemistry principles, structure-based design, and multi-parameter optimization
  • Demonstrated experience developing computational strategies that influence lead development decisions
  • Excellent communication skills to convey complex science to multidisciplinary and senior teams
Vacancy posted 4 days ago
Similar jobs that could be interesting for youBased on the Assistant Principal Scientist, Computational Chemistry in Cambridge, MA vacancy
  • $185k - $240k

     ...seeking an exceptional computational chemist to serve as a...  ..., machine learning scientists, structural biologists...  ...the computational chemistry, machine learning and...  ...role is offered at the Principal or Senior Principal Scientist...  ...and with coding assistants like Claude Code/... 
    Suggested
    Work at office
    2 days per week
    3 days per week

    Antares Therapeutics

    Boston, MA
    a month ago
  • $108k - $162k

     ...highly motivated and experienced computational chemist to join our...  ...data analysis, computational chemistry and AI method development. This...  ...skills and the ability to guide scientists in drug discovery.Key Duties...  ...the Winter), educational assistance programs including student... 
    Suggested
    Full time
    Summer work
    Remote work
    Flexible hours
    2 days per week

    Vertex Pharmaceuticals

    Boston, MA
    4 days ago
  • $115k - $165k

     ...organisms. Senior Engineer I, Computational Synthetic ChemistBoston,...  ...computationally enabled synthetic chemistry. This role sits between the...  ...chemists, computational scientists, and software engineers to define...  ...other service providers to assist in the application process.... 
    Suggested
    Work at office

    Ginkgo Bioworks

    Boston, MA
    4 days ago
  • $223k - $294.25k

     ...Unlocking that information requires new computational approaches — ones that don't yet exist...  ...known. At Tilde, you will work alongside scientists and engineers from diverse disciplines...  ..., and may also be reviewed using AI-assisted screening tools. We do not sell your personal... 
    Suggested

    Seres Therapeutics

    Cambridge, MA
    1 day ago
  •  ...to join our interdisciplinary team of scientists, engineers, researchers, operators, innovators...  ...for all major disease areas. Computation is revolutionizing drug discovery. Advances...  ..., blending expertise in computational chemistry, structural biology, pharmacology, data... 
    Suggested
    Visa sponsorship

    1910

    Boston, MA
    6 days ago
  • 1910, based in Boston, is seeking a Computational Chemist to enhance drug discovery through innovative computational chemistry solutions. In this pivotal role, you will lead programs across various therapeutic modalities, ensuring collaboration with biology and medicinal... 

    1910

    Boston, MA
    6 days ago
  • 1910 in Boston seeks an experienced computational chemist to lead drug discovery efforts. The ideal candidate will have a Ph.D. and extensive...  ...teams, teaching principles of computational chemistry, and progressing drug candidates through the discovery process... 

    1910

    Boston, MA
    6 days ago
  • Job Title: Computational Physical Chemist (Scientist/ Senior Scientist) Job Summary: Alsym Energy is seeking an exceptional computational physical chemist...  ...and development. You will combine deep physical chemistry with machine learning and AI, supported by expertise in... 
    Work at office
    Flexible hours

    Alsym Energy

    Malden, MA
    5 days ago
  • Alsym Energy seeks a Computational Physical Chemist to shape electrolyte discovery and development. You will blend physical chemistry with ML/AI, using MD or DFT to propose formulations and transfer insights into battery performance, lifetime, and safety. Join the Discovery... 

    Alsym Energy

    Malden, MA
    5 days ago
  • $34.13 - $49.63 per hour

     ...process. Job Summary Medical Laboratory Scientist, Senior I - Chemistry Day Shift 7 AM to 3:30 PM As...  ...judgement. - Must have understanding of computer technology and its application to analytical...  ...Frequently (34-66%) 35lbs+ (w/assisted device) Carrying Frequently (34-66%)... 
    Hourly pay
    Immediate start
    Remote work
    Relocation package
    Shift work
    Day shift

    Massachusetts General Hospital

    Boston, MA
    1 day ago
  • $39.59 - $53.28 per hour

     ...difference in people's lives. Medical Lab Scientist II ASCP required. This position is...  ...per established laboratory protocols. Assists with inventory management to maintain...  ...experience required. Experience with computer systems required, including web based... 
    Hourly pay
    Daily paid
    Full time
    Part time
    Work experience placement
    Work at office
    Immediate start
    Relocation package
    Shift work
    Day shift

    Beth Israel Lahey Health

    Boston, MA
    2 days ago
  • $108.5k - $201.5k

     ...transform patients’ lives around the world. As a Principal Scientist I or II, Oligonucleotide Chemistry and Innovation, you will play a critical role in building...  ...Laboratory, Chemical Synthesis, Chemistry, Computational Chemistry, Creativity, Data Analysis, Drug Development... 
    Full time
    Local area
    Worldwide
    Flexible hours

    Novartis

    Somerville, MA
    5 days ago
  • The Broad Institute is seeking a Computational Associate I to join diverse research teams in Cambridge. You will write and refine scripts...  ...models, and contribute to analytical tools used by scientists and clinicians. Applicants should have strong programming skills... 

    Broad Institute

    Cambridge, MA
    1 day ago
  • $170k - $200k

     ...in synthetic and medicinal chemistry, with a demonstrated track record...  ...must be able to integrate computational modeling, structural...  ...talented and passionate team of scientists ~ Be a part of a cutting...  ...available information. These tools assist our recruitment team but do... 

    Psivant Therapeutics, Inc.

    Watertown, MA
    4 days ago
  • In the role of a Computational Associate I, you will have access to the best technologies and...  ...tools Interface and collaborate with scientists, clinicians, and experimental experts at...  ...and family care leave; and an employee assistance program, among other Broad benefits. The... 
    Summer work
    Local area
    Flexible hours

    Broad Institute

    Cambridge, MA
    4 days ago
  •  ...training, and sleep.We are seeking a Staff Applied Machine Learning Scientist to develop and continuously improve production-ready edge...  ...deployment, balancing accuracy with power, memory, latency, and compute constraints across current and future wearable platforms.Set technical... 
    Work at office
    Relocation

    WHOOP

    Boston, MA
    23 hours ago
  • $72k - $76.39k

     ...The Dana-Farber Cancer Institute seeks a Post-Doctoral Computational Biologist in the Gillani Lab in Computational Pediatric Cancer...  ...science to clinical medicine Ability to seek out mentorship and assistance as needed, while also being a mentor to other members of the... 
    Full time
    Contract work
    Work at office
    Flexible hours

    Dana-Farber Cancer Institute

    Boston, MA
    a month ago
  • $150k - $180k

     ...Working with the leader of Molecular Design Chemistry, develop and implement a potential,...  ...environment at the frontier of computational biology, machine learning, and drug discovery...  ...employees and families, employee and family assistance program.  Flexible work environment -... 
    Local area
    Flexible hours
    Weekend work

    Deep Genomics

    Cambridge, MA
    a month ago
  • $120k

     ...create and co-learn research activities and relevant advanced computing capabilities that facilitate and transform collaborative, interdisciplinary...  ...with full vesting after 2 years of eligible service. Tuition Assistance Program: Competitive tuition assistance program for yourself... 
    For contractors
    Work at office
    Remote work

    Boston University

    Boston, MA
    2 days ago
  • Harvard University seeks two research associates for the Needleman lab to develop theoretical and computational approaches for studying complex cell biological systems. Emphasis on statistical inferences and biophysical modeling will drive data analysis from single-cell... 

    Harvard University

    Cambridge, MA
    6 days ago
  • $108k - $162k

     ...Vertex Pharmaceuticals seeks a computational chemist to advance drug discovery through molecular modeling, cheminformatics, and AI-enabled...  ...while contributing to the expansion of computational chemistry capabilities. Responsibilities Apply computational chemistry... 

    Vertex Pharmaceuticals

    Boston, MA
    11 days ago
  • $172k - $236.5k

     ...that drive tangible value. Bringing together engineers, research scientists, and business leaders, we develop new technologies and...  ...neural architecture search to deploy "Modern AI" on efficient compute platforms.Thought Leadership: Maintain a deep awareness of the... 
    Permanent employment
    Full time
    Work at office
    Day shift

    Analog Devices

    Boston, MA
    2 days ago
  • $172k - $236.5k

     ...that drive tangible value. Bringing together engineers, research scientists, and business leaders, we develop new technologies and...  ...algorithms and hardware implementation to define the optimal compute strategy. Operating at the boundary of software and silicon, you... 
    Permanent employment
    Full time
    Work at office
    Day shift

    Analog Devices

    Boston, MA
    4 days ago
  • Assistant Vice President, Principal & Major Gifts (DFCI) Posted on September 02, 2020 The Assistant Vice President (AVP) for Principal & Major Gifts (PMG) works with the Vice President for Principal & Major Gifts and is part of a management team that develops strategic... 
    Contract work
    Temporary work
    Work at office
    Afternoon shift

    Dana

    Brookline, MA
    4 days ago
  • $144.8k - $217.2k

     ...Vertex Pharmaceuticals seeks a computational chemist to lead drug design initiatives using...  ...identification programs, mentoring junior scientists, and collaborating across discovery...  ...Responsibilities Apply computational chemistry methods to accelerate drug candidate discovery... 

    Vertex Pharmaceuticals

    Boston, MA
    25 days ago
  • $174k - $278.4k

     ..., AI Engineering, AI PlatformA quick snapshot…As a Staff Data Scientist, you will be a key technical leader responsible for shaping the...  ...Background. Bachelor’s or Master’s degree in Data Science, Computer Science, Statistics, Mathematics, Engineering, or a related quantitative... 
    Permanent employment
    Full time
    Work at office
    Immediate start
    Worldwide
    Flexible hours

    Conga

    Boston, MA
    4 days ago
  • $168.75k - $270k

     ...experience in full stack software engineeringA bachelor’s degree in Computer Science, Engineering, or a related technical field (or...  ...work. If you have a disability or special need that requires assistance or accommodation during the application or the recruiting process... 
    Work experience placement
    Work at office
    Remote work

    Axon

    Boston, MA
    2 days ago
  •  ...Material Bank is seeking a Staff Applied Scientist to drive building search and...  ...degree in a quantitative field such as computer science, machine learning, statistics, or...  ...disability plans  and have a strong employee assistance program.  Plan for your Retirement :... 
    Temporary work
    Bank staff
    Local area
    Remote work
    Flexible hours

    Material Bank

    Boston, MA
    a month ago
  • $24.28 - $39.43 per hour

     ...Functions -Executes protocols of non-routine experiments. -Assists PI with determining the most suitable methodology. -Performs...  ...-Ability to interpret acceptability of data results. -Strong Computer skills. -Demonstrated competence in research techniques and methodologies... 
    Hourly pay
    Remote work

    Mass General Brigham

    Boston, MA
    5 days ago
  • $32 - $36 per hour

     ...products.Job DescriptionEurofins PSS is seeking a highly motivated scientist to support the client’s Early Formulation Science and Drug...  ...-4 years of experience, or BS with 3-6 years of experience in Chemistry, Chemical Engineering, Physical Chemistry, Physics, Physical... 
    Full time
    Contract work
    Monday to Friday

    Eurofins

    Somerville, MA
    23 hours ago

Do you want to receive more vacancies?

Subscribe and receive similar vacancies to Assistant Principal Scientist, Computational Chemistry. Be the first to apply!