PhD: Towards A Computational Approach At Finite-Temperature Polymorph Screening

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Physical and Environmental Sciences,Chemistry,Materials Science,Physics and Astronomy,Computer Science,Computer Science

Short info about job

Company: University College London

Department: Department of Chemical Engineering

Hours: Full Time

Type / Role: PhD

Phone: +44-1565 7595367

Fax: +44-1267 3551025

E-mail: N\A

Site:

Detail information about job PhD: Towards A Computational Approach At Finite-Temperature Polymorph Screening. Terms and conditions vacancy

Reports to: Dr. Matteo SalvalaglioStipend: circa £16,785 per annum + UK/EU feesStart date: September 2017

Job Advert The Department of Chemical Engineering at University College London (UCL) is seeking an enthusiastic Graduate Student to work on developing a computational approach for the finite-temperature screening of polymorphs. Solid form screening is a critical first step in drug product design. In recent years, improved computational crystal structure prediction (CSP) methods have become an important and increasingly reliable part of the solid form screening process. While CSP methods now frequently identify observed solid forms among the predicted stable forms, CSP also finds many as-yet-unobserved polymorphs among the lowest energy forms. This doctoral project will be focused on the development of a systematic screening approach to refine the solid form landscape from CSP by including temperature effects. This project will be carried out in close collaboration with UCL Chemistry (Prof. Sally Price Group), UCSB Chemical Engineering and Eli Lilly Company. The successful candidate is expected to travel and visit collaborators, if necessary. Key Requirements The candidate will have or is expected to soon obtain an excellent first degree in Chemical Engineering, Chemistry, Physics or an associated discipline. Prior research experience, together with the ability to analyse, develop and solve open-ended research problems is essential. Desirable qualifications include knowledge in crystallization, physical chemistry, molecular simulation techniques, and UNIX-based operative systems.

Further Details

The closing date for this position is 22nd December, or as soon as an appropriate candidate is found.    To apply for this position, please visit the UCL Prism portal: https://www.prism.ucl.ac.uk/#!/?project=218 Please note that full funding is available for UK/EU citizens only. Further details about the studentship are available at the bottom of this page. If you have any queries regarding the vacancy, please contact Dr Matteo Salvalaglio, ([email protected])

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