Lead Computational Chemist
3 days ago
We are seeking a highly experienced Senior Principal Cheminformatics Data Scientist to join our Cheminformatics & Computational Chemistry team. The ideal candidate will have a strong background in cheminformatics, data analysis, and computational modelling, with a deep understanding of computer-aided drug design techniques.
Responsibilities:
- Lead the development of innovative approaches to expand our cheminformatics capabilities and drive long-term strategic thinking within the team.
- Collaborate with medicinal and computational chemists to develop data and modelling pipelines that advance our small molecule drug discovery programmes.
- Apply a wide range of computer-aided drug design techniques to identify and develop small molecules, including virtual screening, reaction and fragment enumeration, de novo design, and chemical library design and sampling.
- Gather, analyse, and report on biochemical data from various sources to derive novel insights into SAR and SPR.
- Build, evaluate, and deliver QSAR models to support our small molecule Drug Discovery programmes.
- Develop processes and customisable workflows that can be adapted and applied across the drug discovery portfolio.
Requirements:
- PhD or equivalent in Chemoinformatics, Computational Chemistry, Molecular Modelling, or a closely related field, with extensive experience in computer-aided drug discovery.
- Detailed knowledge of cheminformatics approaches and their application to live drug discovery projects.
- Extensive practical experience in computer-aided drug design, including compound library design, similarity and substructure searching, virtual screening, reaction enumeration, molecular fragmentation, R-group analysis, and combinatorics.
- Practical experience in developing, deploying, and applying machine learning and QSAR modelling techniques to chemical and biological data.
- Strong programming skills, familiarity with open-source cheminformatics libraries, and experience with cloud computing platforms.
- Innovator of new ideas and approaches in cheminformatics and computational chemistry, with excellent communication and leadership skills.
Estimated Salary: £90,000 - £110,000 per annum
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