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We have 96 molecular modelling PhD Projects, Programmes & Scholarships
molecular modelling PhD Projects, Programmes & Scholarships
We have 96 molecular modelling PhD Projects, Programmes & Scholarships
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Machine Learning and Molecular Modelling in Mass Spectrometry
This PhD project will harness the power of computational modelling and machine learning (A.I.) to analyse data obtained by mass spectrometry experiments and predict structural characteristics of biomolecules and their interactions. Read more
Structure-based design of allosteric modulators for G protein-coupled receptors using molecular modelling and pharmacology experiments
Almost all physiological processes are regulated through the activation of G protein-coupled receptors (GPCRs). It has become widely accepted that most GPCRs possess binding sites spatially distinct from their natural ligand binding site (orthosteric site), termed as allosteric sites. Read more
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PhD Studentship in Machine Learning and Molecular Dynamics
Overview. Interested in machine learning (ML) for molecular modelling? This PhD project aims to develop machine learning inter-atomic potentials (MLIPs) for molecular materials and organic-inorganic interfaces relevant to energy storage technology and medicinal applications. Read more
BBSRC MIBTP - Identification of pathways deregulating neuronal ELAV/Hu RNA binding proteins and alternative splicing in neurodegeneration
Research Group:
BBSRC MIBTP
ELAV/Hu proteins comprise a family of highly conserved neuronal RNA binding proteins important for the development of the nervous system and for neuronal functions. Read more
EPSRC Centre for Doctoral Training in Molecular Sciences for Medicine - 4 year PhD Studentships
Applications are welcome for further projects within our CDT to commence in September/October 2023. Please visit our webpage for up-to-date information regarding the EPSRC Centre for Doctoral Training (CDT) in Molecular Sciences for Medicine (MoSMed). Read more
EPSRC Centre for Doctoral Training in Molecular Sciences for Medicine - 4 year PhD Studentships
Applications are welcome for further projects within our CDT to commence in September/October 2023. Please visit our webpage for up-to-date information regarding the EPSRC Centre for Doctoral Training (CDT) in Molecular Sciences for Medicine (MoSMed). Read more
Predictive control of crystallisation through correlative studies of molecular fragments
This interdisciplinary project presents an exciting opportunity for an ambitious scientist or engineer to work across the boundaries of chemistry, physics and engineering, with opportunities to develop a broad portfolio of skills. Read more
Predicting drug solubility in different solvents using molecular simulation and machine learning
Predicting the solubility of complex drug-like molecules is crucial at several stages of the drug discovery and manufacture. In particular, solvent selection has been highlighted as a crucial step in process design and optimisation [1]. Read more
PhD Studentship in Tribology: Beyond Graphene: Computational Screening of 2D Materials to Eliminate Friction
Applications are invited for a research studentship in the field of “Beyond Graphene. Computational Screening of 2D Materials to Eliminate Friction”, leading to the award of a PhD degree. Read more
A genetic atlas of human molecular phenotypes for causal modelling of disease
Genome wide association studies enable the mapping of genetic effects to molecular phenotypes (such as gene expression levels or protein levels in specific tissues), and those genetic effects can then be mapped to disease traits for causal inference using a statistical framework known as Mendelian randomisation (e.g. Read more
Protein adsorption in gel structures: simulation, experiment and application
The aims of the project are to understand protein adsorption in RF gel structures and to tailor gel properties for applications; these include purification steps in protein manufacture, as well as water clean-up. Read more
Designed Synthesis of Novel Zeolite Catalysts
Nanoporous zeolites play a key role as catalysts in the chemical industry, in reactions as diverse as environmental catalysis and biorefining, and in separation of low molecular weight gases and hydrocarbon vapours. Read more
Experimental and computational investigation of the stabilisation of drug molecules in their amorphous state by mesoporous polymers
The formulation and delivery of poorly soluble drugs has always been a challenge with estimated 70-90% of molecules in the development pipeline suffering from poor solubility and bioavailability. Read more
Synthesis and design of heterogeneous catalysts for the petrochemical industry
The development of novel catalysts for selective oxidation reactions is an area of decisive importance for both industry and academia. Read more
Enhancing PMMA Bone Cement Performance and Biocompatibility using Metal-Organic Frameworks
Applications are invited for a self-funded, 3 year full-time or 6 year part-time PhD project. The PhD will be based in the School of Pharmacy and Biomedical Sciences and will be supervised by Dr Marta Roldo and Professor Paul Cox. Read more
