Computational Chemist jobs in Australia
Find computational chemist jobs with universities, CSIRO, pharmaceutical companies and materials developers across Australia. Computational chemists simulate molecules and reactions to accelerate drug discovery, design new materials and cut experimental cost.
Searched Jobs
Pharmacist
Healthcare & Medical / Pharmacy
Job summary
S.E Ferrington & The Trustee for Ferrington Family Trust t/a Capital Chemist Kingston is looking for a fulltime Pharmacist, to work 38 hours per week.
Computational Chemist (Remote)
Science & Technology
Job summary
Role: Computational Chemistry Expert (PhD)Location: Remote (Work from Anywhere)Job Type: ContractPayout: $40 - $60/hour Role Overview:We are hiring for one of our clients, seeking a Computational Chemistry Expert (PhD) to work on a contract basis.
Computational Chemist (Remote)
Science & Technology
Job summary
Role: Computational Chemistry Expert (PhD)Location: Remote (Work from Anywhere)Job Type: ContractPayout: $40 - $60/hour Role Overview:We are hiring for one of our clients, seeking a Computational Chemistry Expert (PhD) to work on a contract basis.
Pharmacist - Chemist Warehouse Cannon Hill
Healthcare & Medical
Job summary
A career with endless opportunities is closer than you think! $85,000 - $90,000 Plus Super Friendly and Supportive team environment Attractive staff discounts across all our brands and stores Ongoing Training and Professional Development Are you passionate about providing complete patient care and delivering exceptional customer service? Are you excited about being a part of Australia’s Largest Retail Pharmacy Group with over 17,000+ employees across more than 500 stores across Australia?
Pharmacist In Charge - Chemist Warehouse Southbank
Healthcare & Medical
Job summary
A career with endless opportunities is closer than you think!
Pharmacist - Chemist Warehouse Collingwood
Healthcare & Medical
Job summary
A career with endless opportunities is closer than you think! $78,000 - $90,000 Plus Super Friendly and Supportive team environment Attractive staff discounts across all our brands and stores Ongoing Training and Professional Development Are you passionate about providing complete patient care and delivering exceptional customer service? Are you excited about being a part of Australia’s Largest Retail Pharmacy Group with over 17,000+ employees across more than 500 stores across Australia?
Pharmacist - Chemist Warehouse North Sydney
Healthcare & Medical
Job summary
A career with endless opportunities is closer than you think!
Pharmacist - Chemist Warehouse Heidelberg West
Healthcare & Medical
Job summary
A career with endless opportunities is closer than you think!
Pharmacist - Chemist Warehouse Casula DC
Healthcare & Medical
Job summary
A career with endless opportunities is closer than you think! $78,000 to $88,000 Plus SuperFriendly and Supportive team environmentAttractive staff discounts across all our brands and storesOngoing Training and Professional Development Are you passionate about providing complete patient care and delivering exceptional customer service?
Space Management Developer
Retail & Consumer Products
Job summary
About the teamThe Store Operations & Support (SOS) Department ensures the efficient day-to-day operation of all stores.
Frequently Asked Questions
Computational chemists use simulation and modelling to predict how molecules behave. Work includes molecular dynamics and quantum chemistry calculations, virtual screening for drug discovery, materials property prediction, developing models and code, and guiding laboratory experiments towards the most promising candidates.
A PhD in computational or theoretical chemistry is standard for research roles, with strong skills in quantum chemistry software, molecular dynamics packages and programming. Masters graduates with solid modelling and coding experience can enter industry and support scientist positions.
Universities and CSIRO host the largest concentration of roles, spanning drug design, catalysis, energy materials and batteries. Pharmaceutical and biotech companies, mining and materials firms, and national computing facilities also hire, and machine learning growth is expanding industry demand.
Machine learning now accelerates property prediction, force field development and molecule generation, making it a core skill alongside traditional simulation. Employers increasingly seek chemists who combine quantum chemistry foundations with Python-based machine learning, opening roles in both research and industry.
Research pathways progress from postdoc to senior researcher and group leader. Industry pathways lead to senior and principal scientist roles in drug discovery or materials. The programming and modelling skill set also transfers readily into data science and scientific software careers.


