Our Stack

As the leading startup company in computational chemistry for drug design, we have enhanced our drug discovery pipeline with ML-based approaches for predictive modeling of biochemical properties and generative modeling of new molecules  

At Qubit, we take advantage of our accurate physics-based engine for molecular simulations. When combined with state-of-the-art machine learning techniques (Deep Learning, Evolutionary optimization, Gradient Boosting), we can develop an effective hybrid pipeline for chemical space exploration. 

Data Science professionals at Qubit have access to the Atlas platform to deploy their tools, run expensive calculations, and models training at scale. Moreover, Atlas allows Application Scientists at Qubit to access ML tools and predictors to give swift feedback to the data science group and Atlas developers.


As a Data Scientist, you will be in charge of designing and implementing machine learning models to exploit chemical and biological data and participate in the development of new drugs at Qubit Pharmaceuticals.

You will be part of the team in charge of ML-based drug design and generative modeling.

What you’ll be doing

  • Analyze datasets to uncover trends, patterns, and insights that facilitate help in decision making (help guide the strategic planning, use existing data to forecast future performance, etc.)\
  • Apply supervised and unsupervised machine learning methodology to learn insight from the data.
  • Translate business requests into data analysis
  • Check, clean and prepare data to compute and interpret KPIs’ variations and perform descriptive and statistical analysis
  • Quantify uncertainty in your results and test your hypothesis
  • Define, conduct and analyze randomized experiments (like A/B tests)
  • Provide charts and graphics to describe the data for Business Analysts
  • Build and maintain dashboards
  • Document processes and make reproducible analysis so that other members of the organization understand how insights were gathered.

Skills and experiences we are looking for 

Be pragmatic:

Make things as simple and straightforward as possible. Design capabilities are at least as important as statistics and python scripting. Data visualization is also a simple yet very efficient way to valorize your work and make yourself understood by all.

Be customer oriented:

You will be in charge of understanding the needs of our users that are among the greatest scientists in the world of computational chemistry. Their needs are our leads and yet being able to challenge them in a constructive way will be required to get the best out of our platform.

Be agile:

At Qubit Pharmaceuticals our agile sprints are 2 weeks long. We believe that, from time to time, good documentation is better than quick and dirty code. Development quality is at the heart of our agile processes.

Be strong in science:

You have a strong general mathematical background and more specifically in probability and statistics. You have significant experience in Python and its ML “world”. You are able to setup significant mathematical models and associated tests.

Soft Skills and Noble Thought 

Qubit’s culture goes far beyond the ability to write good code. Our team members are self-motivated, flexible, and always learning professionals who can thrive only when surrounded by like-minded people.

POSITION involves stakeholder discussions, awareness about business goals, assessment and identification of improvement areas, all driven by collaboration. 

Loyalty & managed ego: You are deeply loyal and are constantly looking for ways to offer support. Also, you do not hesitate to state what you do not know and ask for help and have no shame in that. 

Proactiveness : You will need the proactiveness and passion towards work, which directly reflects in performance and productivity. Moreover, staying updated with relevant technologies, new tools, and more are part of your process. You always aim for excellence and work hard to achieve it. 

Driven to achieve results with a strategic mindset:  You are tenacious in the face of adversity and carry a can-do attitude. You are a master organizer and project planner; you consistently look ahead and anticipate needs before they arise. You have a sharp mind and  a great judgment for what’s important.  You think fast and execute quickly, but you always think before acting about the consequences of your decisions.

Natural problem solver:  You are analytical and structured in your thinking. You create order out of chaos by identifying systems and processes that need tightening. You deeply understand team and business operations and easily synthesize information to develop a recommended plan of action. 

Caring and sharing attitude: you actively listen to understand what drives or concerns the team and gather input before acting. Once in action, you are able to communicate what to achieve and why, but also how to achieve it. You do not hesitate to share key learnings with your colleagues to help them perform better. 

    To submit your application, fill the fields and submit your CV through this form.