computational chemistry

EPFL in Lausanne invites applications for a Tenure Track Assistant Professor in chemistry and chemical engineering with a strong link to computational modelling. Specific areas include molecular simulations, electronic structure theory, thermodynamic modelling, machine learning and AI methods for separations.We seek candidates with a commitment to teaching...

Position Title PhD position in theoretical and computational chemistry/biophysics in the group of Markus Meuwly in the Department of Chemistry at the University of Basel, Switzerland. Responsibilities and Scope The main theme of our research is the development and application of machine learning‑based energy functions (force fields) for atomistic...

Fully funded PhD position in NCCR Genesis The National Centre of Competence in Research NCCR Genesis is a research infrastructure project funded by SNSF focussing on exploring the emergence of life in the Universe. Project background This interdisciplinary research infrastructure brings together physicists, earth and planetary scientists, chemists and...

EPFL is a leading university with strong emphasis on basic sciences, engineering and life sciences. Research within its Institute of Chemical Sciences and Engineering (ISIC) includes synthetic, biological, physical, analytical, and theoretical chemistry as well as chemical engineering.ISIC is leading an international multi-domain effort to promote the...

About ProximaProxima (formerly VantAI) is advancing an AI-native approach to drug discovery by making protein interactions programmable. Our platform brings together foundation-model machine learning, a scalable data generation engine, and a partnership track record exceeding $5B in collaborations across the world’s leading biopharma and tech...

About ProximaProxima (formerly VantAI) is advancing an AI-native approach to drug discovery by making protein interactions programmable. Our platform brings together foundation-model machine learning, a scalable data generation engine, and a partnership track record exceeding $5B in collaborations across the world’s leading biopharma and tech...

ppAt Roche you can show up as yourself, embraced for the unique qualities you bring. Our culture encourages personal expression, open dialogue, and genuine connections, where you are valued, accepted and respected for who you are, allowing you to thrive both personally and professionally. Join Roche, where every voice matters. /p h3Position /h3 pJoin the...

pRoche and Genentech’s Computational Sciences Center of Excellence seek a Machine Learning Scientist to combine ML with quantum chemistry for small-molecule drug discovery. You will work on models powering drug design and collaborate with top researchers across Roche and academia. /ppIdeal candidates have deep ML expertise, hands-on quantum chemistry with...

Internship Chemistry / Chemical Biology Adaptyv is building an automated lab that enables AI agents to run biology experiments, bridging the gap between computational design and physical execution. Its platform combines a deep software and hardware stack, supporting over 50 companies—from major biopharmas to techbio startups—in running wet lab...

Principal Scientist/ (Associate) Director, Medicinal ChemistryFull-timeAbout usSERAC Biosciences AG is looking for a Principal Scientist/ (Associate) Director, Medicinal Chemistry. Ridgeline Discovery, a Versant Ventures Discovery Engine, creates and operates Versant‑financed innovative biotech companies in partnership with entrepreneurs, industry, and...

About usSERAC Biosciences AG is looking for a Principal Scientist/ (Associate) Director, Medicinal Chemistry.Ridgeline Discovery, a Versant Ventures Discovery Engine, creates and operates Versant-financed innovative biotech companies in partnership with entrepreneurs, industry, and leading academics across Europe. In recent years, Ridgeline has assembled an...

University of Basel, Department of Chemistry, invites applications for a PhD position in theoretical and computational chemistry/biophysics under the supervision of Prof. M. Meuwly.The project focuses on developing machine learning‑based energy functions for atomistic simulations to study reaction mechanisms and molecular dynamics. Candidates should have a...

About usRidgeline Discovery, a Versant Ventures Discovery Engine, creates and operates Versant-financed innovative biotech companies in partnership with entrepreneurs, industry, and leading academics across Europe. In recent years, Ridgeline has assembled an international team of >50 highly experienced drug discovery and industry professionals and built and...

Universität Basel recruits a fully funded Postdoctoral researcher to advance AI-driven drug design within an international DMTA project. The role focuses on developing ML methods for structure-based and generative design, integrating physicochemical features, and validating approaches in prospective drug-discovery cycles with serine protease inhibitors as a...

ph3Postdoctoral Position in AI-Driven Drug Design /h3 pUniversity of Basel ranks among the world’s one hundred best universities and boast a top‑ten place among German‑speaking universities. /p pArtificial intelligence is rapidly transforming molecular design and drug discovery. However, the identification of successful drug candidates requires more...

Postdoctoral Position in AI-Driven Drug Design100% / Available: immediatelyArtificial intelligence is rapidly transforming molecular design and drug discovery. However, the identification of successful drug candidates requires more than generating molecules with high predicted affinity: selectivity, physicochemical properties, potential adverse effects,...

Project backgroundThe Optical Materials Engineering Laboratory (Prof. David J. Norris) in the Department of Mechanical and Process Engineering (D-MAVT) at ETH Zurich investigates the synthesis, growth, structure, and optical properties of semiconductor nanomaterials. Our interdisciplinary and international team combines materials chemistry, optical...

The Optical Materials Engineering Laboratory (Prof. David J. Norris) in the Department of Mechanical and Process Engineering (D-MAVT) at ETH Zurich investigates the synthesis, growth, structure, and optical properties of semiconductor nanomaterials. Our interdisciplinary and international team combines materials chemistry, optical spectroscopy, electron...

Doctoral position in theoretical modeling of nanocrystal growthThe Optical Materials Engineering Laboratory (Prof. David J. Norris) in the Department of Mechanical and Process Engineering (D-MAVT) at ETH Zurich investigates the synthesis, growth, structure, and optical properties of semiconductor nanomaterials. Our interdisciplinary and international team...

LIOM is a Swiss deep-tech company building a health wearable for continuous, needle-free monitoring of body chemistry, starting with glucose. As a Principal/Senior ML Scientist, you will research and collaboratively build computational solutions for real-world problems in this non-invasive smartwatch domain.You will integrate multi-disciplinary knowledge...