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Computational Chemistry (predictive) PhD Projects, Programs & Scholarships

We have 14 Computational Chemistry (predictive) PhD Projects, Programs & Scholarships

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  (BBSRC DTP) A computational model for improving catalytic rate in enzymes
  Dr J Warwicker, Dr S De Visser, Dr S Hay
Application Deadline: 31 January 2020

Funding Type

PhD Type

Directed evolution of enzyme activity is an established methodology, generating biocatalysts that are of benefit for biotechnology, for example in bioenergy production [Turner 2009].
  Prediction of sustainability performance of ionic liquids using a group contribution framework
  Dr R Cuellar-Franca, Dr C Avendano, Prof C Hardacre
Applications accepted all year round

Funding Type

PhD Type

The versatility and wide range of applications of ionic liquids (ILs) offer industry with endless possibilities for sustainable innovation.
  (A*STAR) Protein solubility in biology and biotechnology
  Dr J Warwicker, Dr R Curtis
Application Deadline: 31 January 2020

Funding Type

PhD Type

Protein aggregation is an issue in biology and biotechnology. A wealth of studies have focussed on proteinopathies and neurodegenerative diseases in particular.
  (BBSRC DTP CASE) Intelligent Engineering of Bacterial Genomes
  Prof R Breitling, Prof E Takano
Application Deadline: 31 January 2020

Funding Type

PhD Type

The goal of this project is to establish methodology for the intelligent engineering of biological hosts for the production of high-value drugs and chemicals.
  Computer-aided molecular design: improved ligand docking using electronic structure and molecular dynamics simulations
  Dr R A Bryce, Dr N Burton
Applications accepted all year round

Funding Type

PhD Type

In structure-based drug design, computational modelling techniques are frequently used to predict the orientation and affinity with which a ligand binds to its protein receptor.
  Exploring the influence of proteogenomics in patients receiving biologic drugs for treatment of psoriatic arthritis
  Prof A Barton, Dr James Bluett, Dr N Nair
Applications accepted all year round

Funding Type

PhD Type

Background. Psoriatic arthritis (PsA) is an inflammatory arthritis, associated with the chronic skin condition psoriasis, which causes joint inflammation.
  Identifying biomarkers that may affect diabetes comorbidity
  Dr S Watterson, Dr P McClean
Application Deadline: 7 February 2020

Funding Type

PhD Type

It is estimated that 415 million people worldwide suffer from diabetes which will rise to 642 million by 2040 [1]. Ninety percent of cases are type 2 diabetes (T2D).
  Directed assembly of pharmaceutical materials: Lessons from intermolecular interactions (KHIMYAKYU20SCIEP)
  Prof Y Khimyak, Dr L Fábián, Dr J Wright
Application Deadline: 30 January 2020

Funding Type

PhD Type

This will contribute to the development of artificial intelligence (AI) methods for predicting self-assembly of multicomponent pharmaceutical solids.
  KESS2 Scholarship: Machine Learning in 3D Wound Care (MastersbyResearch)
  Prof J Kenkre
Application Deadline: 1 April 2020

Funding Type

PhD Type

Here is an exciting opportunity to apply computerised machine-learning technology to improve the automated clinical assessment of chronic skin wounds and ulcers.
  PhD Studentship – Predicting Skin Interactions and Permeation of Chemical Agents using Computational Modelling
  Prof J W Essex
Applications accepted all year round

Funding Type

PhD Type

Co-Supervisor. Dr Thomas J Piggot (Dstl). The skin is the outermost barrier for most of the human body. The majority of chemicals that come into contact with the body will initially do so through an interaction with the skin.
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