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computational chemistry PhD Projects, Programs & Scholarships

We have 178 computational chemistry PhD Projects, Programs & Scholarships

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Interfacing radical and organometallic chemistry
University of Strathclyde Pure and Applied Chemistry
This project is funded at the University of Strathclyde (supervisor for this studentship). Prof John Murphy. Read more
 Supervisors: Prof JA Murphy, Prof T Tuttle
 Year round applications PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Awaiting Funding Decision/Possible External Funding

Awaiting Funding Decision/Possible External Funding

This supervisor does not yet know if funding is available for this project, or they intend to apply for external funding once a suitable candidate is selected. Applications are welcome - please see project details for further information.

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A 3-year PhD studentship in Computational Prediction of Novel Thermoelectric Semiconductors
University College London Centre for Doctoral Training in Molecular Modelling and Material Science, UCL
The studentship. This position is fully funded by the UCL-A*STAR Collaborative Programme via the Centre for Doctoral Training in Molecular Modelling and Materials Science (M3S CDT) at UCL. Read more
 Supervisor: Dr D Scanlon
Open Day(s)  31 July 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Competition Funded PhD Project (European/UK Students Only)

Competition Funded PhD Project (European/UK Students Only)

This project is in competition for funding with other projects. Usually the project which receives the best applicant will be successful. Unsuccessful projects may still go ahead as self-funded opportunities.

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Computational approaches to chemical synthesis
University of Sheffield Department of Chemistry
Computational chemistry, machine learning and big data approaches are poised to change how chemical synthesis is carried out. Read more
 Supervisor: Dr JG Hill
 Year round applications PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Self-Funded PhD Students Only

Self-Funded PhD Students Only

This project does not have funding attached. You will need to have your own means of paying fees and living costs and / or seek separate funding from student finance, charities or trusts.

More Details
Developing Photo-Electrochemistry in Synthetic Organic Methodology
University of Bristol Chemistry
Both photoredox catalysis and synthetic organic electrochemistry are emerging technologies that have been gaining in popularity in recent years. Read more
 Supervisor: Dr A Lennox
 31 March 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Funded PhD Project (Students Worldwide)

Funded PhD Project (Students Worldwide)

This project has funding attached, subject to eligibility criteria. Applications for the project are welcome from all suitably qualified candidates, but its funding may be restricted to a limited set of nationalities. You should check the project and department details for more information.

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Simulation-led investigation and engineering of enzymes involved in abyssomicin antibiotic biosynthesis
University of Bristol School of Biochemistry
Enzymes are remarkable biocatalysts that allow rapid, selective and efficient catalysis under mild conditions. Biotechnology exploits the outstanding rate-enhancing properties of these natural biocatalysts to manufacture high added-value products. Read more
 Supervisors: Dr M van der Kamp, Dr P Race, Prof C L Willis
 Year round applications PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Self-Funded PhD Students Only

Self-Funded PhD Students Only

This project does not have funding attached. You will need to have your own means of paying fees and living costs and / or seek separate funding from student finance, charities or trusts.

More Details
Predictive simulations of molecules in membranes
Durham University Department of Chemistry
This computational project will tackle fundamental questions in physical chemistry that are also of great industrial significance. The four-year studentship… Read more
 Supervisor: Dr MA Miller
 19 March 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Funded PhD Project (Students Worldwide)

Funded PhD Project (Students Worldwide)

This project has funding attached, subject to eligibility criteria. Applications for the project are welcome from all suitably qualified candidates, but its funding may be restricted to a limited set of nationalities. You should check the project and department details for more information.

More Details
Exploring chemical space for computational materials discovery
University of Southampton Chemistry
Supervisory Team.    Prof. Graeme Day. Project description. A fully funded PhD studentship is available in the area of computational materials discovery, as part of a prestigious international Synergy grant. Read more
 Supervisor: Prof G Day
 31 August 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Competition Funded PhD Project (UK Students Only)

Competition Funded PhD Project (UK Students Only)

This research project is one of a number of projects at this institution. It is in competition for funding with one or more of these projects. Usually the project which receives the best applicant will be awarded the funding. The funding is only available to UK citizens or those who have been resident in the UK for a period of 3 years or more. Some projects, which are funded by charities or by the universities themselves may have more stringent restrictions.

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Atmospheric chemistry of new green solvents
University of York Department of Chemistry
Background. Solvents make up the bulk of waste from the chemical industry yet little attention is paid to the environmental impact of these volatile organic compounds (VOC) once released to the atmosphere {1-2}. Read more
 Supervisors: Dr T J Dillon, Dr R McElroy
 Year round applications PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

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Self-Funded PhD Students Only

Self-Funded PhD Students Only

This project does not have funding attached. You will need to have your own means of paying fees and living costs and / or seek separate funding from student finance, charities or trusts.

More Details
Design of next generation antibody therapies using structure-guided approaches
University of Southampton Biological Sciences
Monoclonal antibodies can target immune checkpoints to deliver novel therapies for cancer. Read more
 Supervisors: Dr I Tews, Prof J W Essex
 21 March 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Funded PhD Project (UK Students Only)

Funded PhD Project (UK Students Only)

This research project has funding attached. It is only available to UK citizens or those who have been resident in the UK for a period of 3 years or more. Some projects, which are funded by charities or by the universities themselves may have more stringent restrictions.

More Details
Machine learning methods in crystal structure prediction
University of Southampton Chemistry
Supervisory Team.    Prof. Graeme Day. This project will develop computational methods to guide the discovery of new materials, combining state-of-the-art computational methods for crystal structure prediction (CSP) with machine learning approaches for interpreting the predicted crystal structure landscapes. Read more
 Supervisor: Prof G Day
 31 August 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Competition Funded PhD Project (UK Students Only)

Competition Funded PhD Project (UK Students Only)

This research project is one of a number of projects at this institution. It is in competition for funding with one or more of these projects. Usually the project which receives the best applicant will be awarded the funding. The funding is only available to UK citizens or those who have been resident in the UK for a period of 3 years or more. Some projects, which are funded by charities or by the universities themselves may have more stringent restrictions.

More Details
Design, synthesis and evaluation of novel polysialyltransferase inhibitors as anti- metastatic agents
University of Bradford Faculty of Life Sciences
  Research Group: Institute of Cancer Therapeutics
Polysialic acid plays an essential role in neuronal development, but by adulthood is absent from the human body. Its biosynthesis is regulated by two polysialyltransferases (polySTs). Read more
 Supervisors: Dr R Falconer, Dr S Shnyder
 Year round applications PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Self-Funded PhD Students Only

Self-Funded PhD Students Only

This project does not have funding attached. You will need to have your own means of paying fees and living costs and / or seek separate funding from student finance, charities or trusts.

More Details
Mobile Robotic Chemists for Autonomous Synthetic Chemistry
University of Liverpool Department of Chemistry
Industrial chemistry labs have not changed significantly in the last 25 years. The vast majority of experimentation supporting late phase drug development activities is performed manually one reaction at a time. Read more
 Supervisors: Dr JW Ward, Prof A I Cooper
 31 March 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Funded PhD Project (Students Worldwide)

Funded PhD Project (Students Worldwide)

This project has funding attached, subject to eligibility criteria. Applications for the project are welcome from all suitably qualified candidates, but its funding may be restricted to a limited set of nationalities. You should check the project and department details for more information.

More Details
Towards Earth-Abundant Electrolyser Components for Green Hydrogen
University of Liverpool Department of Chemistry
This position will remain open until filled and so early applications are encouraged. A Ph.D. Read more
 Supervisors: Prof M J Rosseinsky, Prof A Cowan, Dr R Chen
 Year round applications PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Funded PhD Project (UK Students Only)

Funded PhD Project (UK Students Only)

This research project has funding attached. It is only available to UK citizens or those who have been resident in the UK for a period of 3 years or more. Some projects, which are funded by charities or by the universities themselves may have more stringent restrictions.

More Details
Medicinal Chemistry Optimisation of Novel Heterocyclic Anti-infective Agents
University of Liverpool Department of Chemistry
The Medicinal Chemistry Groups at Liverpool is one of Europe’s leading academic groups focused on early stage drug discovery. Read more
 Supervisors: Prof P O'Neill, Dr WD Hong
 25 March 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Funded PhD Project (European/UK Students Only)

Funded PhD Project (European/UK Students Only)

This project has funding attached for UK and EU students, though the amount may depend on your nationality. Non-EU students may still be able to apply for the project provided they can find separate funding. You should check the project and department details for more information.

More Details
PhD Position, Molecular Simulation of Chemistry in Nanoconfinement, Ruhr University Bochum
Ruhr-University Bochum Ruhr-University Bochum
PhD Position, Molecular Simulation of Chemistry in Nanoconfinement, Ruhr University Bochum (Germany). Applications are invited for a PhD student position, which is available immediately or upon mutual agreement (latest starting date is July 01, 2021). Read more
 Supervisor: Prof L Schaefer
 30 March 2021 PhD Research Project

PhD Research Project

PhD Research Projects are advertised opportunities to examine a pre-defined topic or answer a stated research question. Some projects may also provide scope for you to propose your own ideas and approaches.

View All
Funded PhD Project (Students Worldwide)

Funded PhD Project (Students Worldwide)

This project has funding attached, subject to eligibility criteria. Applications for the project are welcome from all suitably qualified candidates, but its funding may be restricted to a limited set of nationalities. You should check the project and department details for more information.

More Details

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