Hyper Recruitment Solutions
Associate Scientific Director - Computational Chemistry

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ROLE OVERVIEW
A leading organisation in the industry is seeking a Principal Scientist / Associate Scientific Director – Computational Chemistry to join their team based in the UK on a hybrid working model (remote working can be considered for the right candidate).
As the Principal Scientist / Associate Scientific Director – Computational Chemistry, you will be at the forefront of solving complex drug discovery challenges and guiding medicinal chemistry programmes.
KEY DUTIES AND RESPONSIBILITIES:
Your duties as the Principal Scientist / Associate Scientific Director – Computational Chemistry will be varied however the key duties and responsibilities are as follows:
- Deliver high-quality computational chemistry support across drug discovery programmes, from target identification through to clinical candidate nomination.
Reasons to use Rodeo
I’m in my final year doing Economics and I don’t know whether to apply for grad schemes now or do a masters first. What do you think?
Honest answer — it depends on where you want to end up. A lot of top grad schemes (Big 4, civil service, banking) don’t need a masters. Let’s look at the ones you’d be competitive for now, and we can decide if a masters actually adds anything.
Also worth knowing: most autumn 2026 applications are open now. Timing matters more than you think.
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Graduate Consultant — 2026 Scheme
Why you're a good match
StrongYour economics background and your summer at a regional bank line up with what PwC looks for on the consulting scheme. Applications close in four weeks.
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Why you're a good match
You’ve got the grades and the economics background, and your bank internship is exactly the experience this scheme looks for. Apply soon — deadlines close within the month.
Experience fit
Your summer at the bank plus your econometrics coursework map directly to the day-one responsibilities on this scheme — client modelling, market briefings, and deal support.
Only hits
No noise. No "maybe this fits." Just roles with a clear explanation of why they're right — and where to focus when applying.
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Apply structure-based and ligand-based small molecule drug design methods including docking, QSAR, pharmacophore modelling, virtual screening, MD and QM calculations, to guide medicinal chemistry and solve complex design challenges.
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Provide expert guidance to medicinal chemists and multidisciplinary project teams, integrating computational insight with experimental data.
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Mentor and develop computational chemists, setting high standards for scientific thinking, quality, and integrity.
ROLE REQUIREMENTS:
To be successful in your application to this exciting role as the Principal Scientist / Associate Scientific Director – Computational Chemistry we are looking to identify the following on your profile and past history:
- Relevant degree in computational chemistry or a closely related discipline.


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Your very own career expert that helps elevate your application to the next level.
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Extensive industry experience in drug discovery within pharma, biotech, or CRO settings.
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A working knowledge and practical experience with structure-based and ligand-based small molecule drug design and the practical application of computational tools.
Key Words: Principal Scientist / Associate Scientific Director / Computational Chemistry / Drug Discovery / Medicinal Chemistry / Structure-Based Design / Ligand-Based Design / QSAR / Pharmacophore Modelling / Virtual Screening
Hyper Recruitment Solutions Ltd (HRS) is an Equal Opportunities employer. We welcome applications from anyone who meets the role requirements. HRS exclusively supports the Life Science sectors, combining recruitment expertise with scientific knowledge to help you advance your career.
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