
Senior Computational Chemist Lead
10 hours ago
At Orion Oyj, we're seeking a highly skilled Digital Medicinal Chemistry Professional to join our Molecular Prospecting and Modeling Unit. This role is designed for an experienced investigator who takes ownership of multi-parameter optimization (MPO) in small molecule drug discovery projects, actively embedding computational insights into decision-making.
About the Role
The successful candidate will be at the interface of medicinal chemistry and computational drug discovery, ensuring that advanced computational techniques effectively guide early-stage drug discovery. You will work closely with medicinal chemistry teams and other computational deep domain experts to identify and exploit opportunities for data-driven decision-making.
- Proactively contribute to structural ideation and evaluate novel structure-based hypotheses together with medicinal chemists while balancing overall molecular properties
- Run and interpret virtual screening campaigns
- Finding novel computational generative and predictive approaches to complement current project toolboxes and drive molecular optimization in a data-driven fashion
- Scrutinize and report automated machine learning (AutoML) model results to the chemistry team
- Explore and validate custom computational models, coordinating their delivery into LiveDesign
- Elucidate details and limitations of current structural insights, leveraging both experimental and computational data
- Investigate compound bioactive conformations and levels of uncertainty
- Ensure relative and absolute binding free energy (RBFE/ABFE) methods are validated and applied where applicable
This is a full-time position based in Finland. Some travel may be required between our main research sites. You can work flexibly in a hybrid model in accordance with our guidelines.
We Offer
At Orion Oyj, your work directly contributes to improving the lives of patients worldwide. We provide:
- A collaborative and scientifically stimulating environment with top-tier professionals
- Opportunities to shape the future of computational drug discovery within our organization
- Access to cutting-edge technology and data science tools
- Competitive salary, generous health and welfare benefits, and support for international relocation
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