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docking PhD Projects, Programs & Scholarships

We have 12 docking PhD Projects, Programs & Scholarships

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  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
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.
  Targeting myosin for heart disease: a structure-based approach to design conformation-selective modulators
  Dr A Fornili, Dr J Ochala
Application Deadline: 31 January 2019
Applications are invited for a PhD studentship starting from September 2019 in Dr. Arianna Fornili’s group at Queen Mary University of London and in collaboration with Dr.
  Interaction of selected phosphor-peptides and organic molecules with 14-3-3 proteins
  Dr J Hritz, Assoc Prof V Bryja, Prof V Bryja
Application Deadline: 3 February 2019
14-3-3 proteins play key role in the neurobiochemistry of brain and are also associated with neurodegenerative amyloid diseases such as Alzheimer and Parkinson disease.
  Regulation of BCR signalling by DNA damage response and P53 protein
  Prof M Mráz
Application Deadline: 15 March 2019
We are looking for a motivated PhD student that would like to work on the following project funded by the ERC (European Research Council) Starting grant.
  Effect of Big data and Linked Open Data in innovation of IPR management processes (REF: SF18/BAM/DAMIJ)
  Dr N Damij
Applications accepted all year round
Intellectual Property Rights (IPR) data can shape (present and future) investment decisions in R&D, protect companies freedom to operate, assess the value…
  Efficient calculation of binding free-energies and druggability in challenging drug targets
  Prof F Gervasio
Application Deadline: 3 June 2019
This four year PhD research project, due to start in October 2019, is a collaboration between University College London and UCB pharma, a global biopharmaceutical company (
  (A*STAR) Structure-based ligand discovery targeting protein kinases for antifungal therapy
  Dr L Tabernero, Dr M Bromley
Application Deadline: 31 January 2019
Fungal infections pose a serious threat to health affecting about 1.7 billion people worldwide and causing about 1.5 million deaths each year.
  Exploiting druggability host spots in protein phosphatase targets
  Dr L Tabernero, Prof D Procter, Dr S Butterworth
Applications accepted all year round
In the past years the use of virtual screening or computer-based screening of compound libraries against selected targets has expanded exponentially the boundaries of drug discovery.
  (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 2019
This project will use computational approaches to couple a widely accepted feature of importance in enzyme activity to visualisation and prediction.
  Identification, screening and scale up of enzymes in the Biocatalyst Discovery Metagenomics platform
  Prof N Scrutton, Prof N Turner
Applications accepted all year round
Background – Enzyme engineering strategies, supported by computational and molecular modelling to maximise speed and efficiency, has been shown to be a powerful tool for (semi-) rational design of enzymes.1,2 We will evaluate protein mobility/dynamics, docking/binding of substrates and calculation of free energy barriers for catalysis.
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