computational chemistry

DescriptionFunded by the Danish e-Infrastructure Cooperation - DeiC National Quantum Algorithm Academy, we have an opening for a three-year PhD position in the group of Professor Sonia Coriani at DTU Chemistry to work on the development of quantum algorithms tailored to noisy-intermediate scale (NISQ) and early-fault-tolerant (EFTQC) devices for the...

PhD scholarship in Hybrid Quantum Algorithms for Computational X-ray Spectroscopy on Noisy-Intermediate Scale and Early-Fault-Tolerant Quantum Computers - DTU Chemistry Funded by the Danish e-Infrastructure Cooperation - DeiC National Quantum Algorithm Academy, we have an opening for a three-year PhD position in the group of Professor Sonia Coriani at DTU...

Job DescriptionThese days, the inner workings of molecules and materials can be probed and modelled by advanced simulation tools on modern computer architectures. However, the routine applications of the overwhelming majority of all such tools in existence today yield properties that fail to map to bonds, the entities of main interest to most of synthetic...

These days, the inner workings of molecules and materials can be probed and modelled by advanced simulation tools on modern computer architectures. However, the routine applications of the overwhelming majority of all such tools in existence today yield properties that fail to map to bonds, the entities of main interest to most of synthetic chemistry. To...

These days, the inner workings of molecules and materials can be probed and modelled by advanced simulation tools on modern computer architectures. However, the routine applications of the overwhelming majority of all such tools in existence today yield properties that fail to map to bonds, the entities of main interest to most of synthetic chemistry.To that...

DescriptionThese days, the inner workings of molecules and materials can be probed and modelled by advanced simulation tools on modern computer architectures. However, the routine applications of the overwhelming majority of all such tools in existence today yield properties that fail to map to bonds, the entities of main interest to most of synthetic...

Does it excite you to work with computational and AI methods at the forefront of multi-modality drug discovery, and do you have experience leading computational scientists and applying structure-based design, machine learning, and generative modeling to real pipeline decisions? If this sounds like you, and you are ready to take on a broad area of...

Does it excite you to work with computational and AI methods at the forefront of multi-modality drug discovery, and do you have experience leading computational scientists and applying structure-based design, machine learning, and generative modeling to real pipeline decisions? If this sounds like you, and you are ready to take on a broad area of...

DescriptionJoin a research environment focused on developing next-generation computational methods for molecular systems where standard electronic-structure approaches reach their limits. Many chemically important reactions, including catalytic and bioinorganic processes, involve electronic structures that change qualitatively along the reaction path....

Zealand Pharma A/S in Copenhagen, Denmark, invites a Senior Director, Computational Drug Discovery to mentor a global team across Copenhagen and Cambridge. You will set the vision, drive computational strategy, and align with Chemistry, DMPK, and AI initiatives to accelerate pipeline decisions.You will lead cross-functional collaboration, foster innovation,...

Does it excite you to work with computational and AI methods at the forefront of multi-modality drug discovery, and do you have experience leading computational scientists and applying structure-based design, machine learning, and generative modeling to real pipeline decisions? If this sounds like you, and you are ready to take on a broad area of...

DTU, located in Kgs. Lyngby, Denmark, invites applications for a PhD position focused on developing automated and data-driven computational methods for complex chemical reactions.The project spans quantum chemistry, machine learning, and materials science, with close collaboration to national and international partners. You will contribute to method...

Job portalJob DescriptionAs a Postdoctoral researcher, you will develop, implement, and apply state-of-the-art computational strategies for structure-based peptide design, leveraging recent advances in AI-based structure prediction and co-folding (e.g. AlphaFold-class methods), molecular modeling software such as Rosetta, and GPU-accelerated computing. You...

DescriptionAre you interested in using automation and machine learning to make the discovery of new materials and catalysts faster and more sustainable? Do you want to start your scientific career building self-driving laboratories at the interface between computational chemistry, nanomaterials synthesis, and reaction engineering? Join us at DTU Chemistry...

DTU – Technical University of Denmark is offering a PhD position focused on developing automated and data-driven computational approaches for complex chemical reactions. The project blends quantum chemistry, machine learning, numerical optimization, and molecular modelling to enable robust reaction-path datasets and reference calculations.You will join an...

Funded by the Danish e-Infrastructure Cooperation - DeiC National Quantum Algorithm Academy, we have an opening for a three-year PhD position in the group of Professor Sonia Coriani at DTU Chemistry to work on the development of quantum algorithms tailored to noisy-intermediate scale (NISQ) and early-fault-tolerant (EFTQC) devices for the computation of...

Senior Scientist, Platform Chemistry Location: Copenhagen, DenmarkEmployment type: Full-time Are you passionate about peptide chemistry and platform innovation?We are looking for an experienced Senior Scientist to join a Platform Chemistry team in Copenhagen.This role combines hands-on peptide chemistry, platform development and cross-functional...

Your new position As Senior Director, Computational Drug Discovery, you will mentor and grow a global team across two sites — Cambridge, USA and Copenhagen, DK — setting the vision and driving the computational strategy to support Zealand's multi-modal pipeline including peptides, small molecules and antibodies. Partnering closely with Molecular Platform...

Job Description Join a research environment focused on developing next-generation computational methods for molecular systems where standard electronic-structure approaches reach their limits. Many chemically important reactions, including catalytic and bioinorganic processes, involve electronic structures that change qualitatively along the reaction path....

Join a research environment focused on developing next-generation computational methods for molecular systems where standard electronic-structure approaches reach their limits. Many chemically important reactions, including catalytic and bioinorganic processes, involve electronic structures that change qualitatively along the reaction path. Describing such...