What I cannot create, I do not understand. -- Richard Feynman
What I cannot create, I do not understand. -- Richard Feynman
I am a Lecturer in Department of Computer Science at Brunel University London.
My research focus is on developing computational models for Rational Biomolecular Design.
Please check out our first steps towards rational design:
PyCoM: largest database on inter-residue coevolution data
DyNoPy: A computational pipeline to coevolving dynamically coupled residue pair.
In this interdisciplinary quest, we simulate biomolecules using GROMACS or AMBER packages, on ARCHER2 or MMM Young computing facilities, and analyse the data developing/using various computational tools, and eventually report it to the world. For a quick example on how molecular dynamics simulations look like, please visit Prof. Bert de Groot's web page.
Experimental work is carried out in the labs of my wonderful collaborators listed below.
If you would like to know more about any of the projects or interested in collaboration, please get in touch via email.
Collaborators
Dr Dalia Chakrabarty (University of York, UK)
Dr James Garnett (KCL, UK)
Professor Shozeb Haider (UCL, UK)
Dr Avinash Kale (CEBS, University of Mumbai, India)
Professor Ashutosh Kumar (IIT Bombay, India)
Professor Faruck Morcos (UT Dallas, USA)
Dr Alessandro Pandini (Brunel University of London, UK)
Dr Giuseppe Sicoli (CNRS Lille, France)