Lead ML Scientist - Molecular AI

Novo Nordisk; Waltham (MA); Hybrid; USD 122.000 - 223.000; Vollzeit

Benefits dieser Stelle

Medical, dental and vision coverage

Life insurance

401(k) savings plan

Tuition reimbursement

Zusammenfassung

NOVO NORDISK in the United States (Waltham, MA) is seeking a Lead ML Scientist for Molecular AI (MolAI) within the AI and Digital Innovation area. You will develop generative AI methods for computational drug design, translate insights into experiments, and collaborate across global teams to advance novel medicines.

The role requires advanced degrees and substantial experience in AI/ML, with exposure to healthcare or regulated environments.

Qualifikationen

• Experience in modeling and AI/ML algorithm development and validation.
• Knowledge of deep learning and reinforcement learning concepts.
• Exposure to healthcare or regulated fields is advantageous.
• Experience with data management and science tools like Jupyter, Matlab, R Studio.

Aufgaben

• Lead research and development of generative AI methods for molecular design.
• Translate computational insights into experimental strategies and train models.
• Publish research in top venues and build external collaborations.
• Mentor junior ML scientists and engineers, promoting reproducibility.

Kenntnisse

Deep learning

Bayesian reasoning

Recommendation systems

Active/reinforcement learning

ML software systems

Mobile ML

Healthcare industry

Regulated field

Leadership in tech

Data management tools

Ausbildung

Bachelor's degree (required)

Master’s or PhD preferred

Tools

Jupyter Notebook

Matlab

R Studio

Jobbeschreibung

About The Department

Our Research & Development organization brings together the best minds in life science innovation. The teams located in facilities in Lexington, Watertown, Cambridge and Plainsboro reflect the full R&D continuum, from early research through late-stage clinical development. Here, we are building for the future, creating a distinct R&D community based on collaboration, partnerships, and cutting-edge research across multiple modalities and therapeutic areas. We recognize that improving human health starts here and that patients rely on us. Our R&D hub merges biotech speed and agility with large pharmaceutical company quality, resources, and stability, uniting the best of both worlds to develop new medicines for patients.

The Position

The Molecular AI (MolAI) team is part of Novo Nordisk’s AI and Digital Innovation (ADI) area where we apply and develop state of the art capabilities in predictive science, AI/ML and structure-based drug design. Scientists within MolAI collaborate seamlessly with teams across the globe to invent better molecules faster. With an unbiased approach to drug modalities, in-house access to the newest screening techniques, and world-class experimentation, we have a wealth of opportunities to impact our pipeline and ultimately save and improve patient lives. We work in multidisciplinary, highly collaborative discovery teams both locally and across Novo Nordisk’s global network to invent novel medicines by applying advanced computational techniques and developing innovative computational methods. We engage in external collaborations to ensure access to cutting edge research and technology.

Relationships

The Lead ML Scientist – Molecular AI reports to the Director of Molecular AI and interacts closely with colleagues in the department and in the other departments within AI and Digital Innovation (ADI), in particular the area of Digital Chemistry and Design, to drive the applications of generative AI within R&D’s computational drug discovery portfolio. Additional internal partners include experimental and data scientists, specialists, engineers, software developers, technology scouts & partnership developers and others across US and Denmark. External relationships include commercial and academic collaboration partners.

Essential Functions

• Provide senior scientific leadership: identify capability gaps, set goals, and lead initiatives that deliver business impact.
• Lead research and development of generative AI methodologies for computational drug design; advance, optimize, and deploy models that balance multiple design criteria.
• Translate computational insights into experimental strategies and leverage the organization’s substantial data-generation capabilities to train and validate models.
• Develop and implement new deep learning approaches (e.g., diffusion models, reinforcement/active learning, LLMs for molecular design) and maintain a well-documented, reusable codebase with traceable model history.
• Represent MolAI externally and internally: publish in top venues, present at conferences, and build collaborations with academic and commercial partners.
• Mentor and grow talent: lead, guide, and develop junior ML scientists and engineers; promote best practices in version control, CI/testing, and model reproducibility.
• Participate in cross-functional teams and program readouts, partnering closely with Digital Chemistry and Design, experimental scientists, research engineers, and IT.
• Publish research in developing AI methods (example in ICLR, NeurIPS, ICML, Nature, Science, Cell etc.)

Physical Requirements

0-10% overnight travel required. This position (hybrid) is in Waltham, MA.

Qualifications

• Bachelor’s degree required. Master’s degree or PhD preferred. Degree within subject matter expertise preferred
• A Bachelor’s degree with 8+ years’ relevant experience, or Master’s Degree with 5+ years’ relevant experience, or PhD with 4+ years’ relevant experience can be considered
• Relevant experience includes:
• Experience in modeling, diseases modeling, physiological modeling, big data analytics and AI/ML algorithm development and validation
• Knowledge of at least 4 of the following is required: deep learning, Bayesian reasoning, recommendation systems, learning from semi-structured data, reinforcement or active learning, machine learning (ML) software systems, machine learning on mobile devices
• Knowledge and/or professional experience in healthcare industry, especially disease management
• Experience in pharmaceutical industry, healthcare industry, regulated medical device development or in another regulated field
• Experience in leading technology, software, or hardware development
• Experience with data management and science tools such as Jupyter Notebook, Matlab, R Studio, etc
• Preferred experience includes:
• Solid understanding of metabolic disease states is required. Deep knowledge of Diabetes and/or Obesity along with the molecular and physiological role of drug, food and other factors relating to the diseases, is preferred
• Additional preferred experience includes insert subject matter preferred experience
• Excellent written and oral communication skills
• Detail oriented with strong documentation skills
• Demonstrated ability to generate valuable and relevant ideas, create concepts based on ideas and develop new products based on concepts

The base compensation range for this position is $122,300K to $222,600K. Base compensation is determined based on a number of factors. This position is also eligible for a company bonus based on individual and company performance. Novo Nordisk offers long-term incentive compensation and or company vehicles depending on the position's level or other company factors.

Employee Benefits

• medical, dental and vision coverage
• life insurance
• disability insurance
• 401(k) savings plan
• flexible spending accounts
• employee assistance program
• tuition reimbursement program
• group legal
• critical illness
• identity theft protection
• pet insurance
• auto/home insurance
• time off pursuant to its sick time policy, flex-able vacation policy and parental leave policy.

We commit to an inclusive recruitment process and equality of opportunity for all our job applicants.

When you join us, you become part of something bigger - a legacy of impact that reaches far beyond today.

At Novo Nordisk, we're not chasing quick fixes - we're creating lasting change for long-term health. For over 100 years, we've been driven by a single purpose: to defeat serious chronic diseases and help millions of people live healthier lives. This dedication fuels our constant curiosity and inspires us to push the boundaries of what's possible in healthcare. We embrace diverse perspectives, seek out bold ideas, and build partnerships rooted in shared purpose. Together, we're making healthcare more accessible, treating and defeating diseases, and pioneering solutions that create change spanning generations.

Novo Nordisk is an equal opportunity employer. Qualified applicants will receive consideration for employment without regard to race, ethnicity, color, religion, sex, gender identity, sexual orientation, national origin, disability, protected veteran status or any other characteristic protected by local, state or federal laws, rules or regulations.

If you are interested in applying to Novo Nordisk and need special assistance or an accommodation to apply, please call us at 1-855-411-5290. This contact is for accommodation requests only and cannot be used to inquire about the status of applications.