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1984

Sawafta, Reyad Ilayan Tawfig, 1958-

2002

Ballentine, Gregory Edward

2004

Menon, Geetha Vijayan

1991

Twamley, Jason Mark.

1977

Churney, Garth

2003

Kwan, Alexander Lun Chor

Spring 2012

Barakat, Khaled H.

Developing a new drug is a complex, highly structured, and expensive task. The further a potential drug progresses in the development process, the more costly its failure becomes. Virtual screening (VS) is the initial stage of a drug discovery process. Its job is to screen large compound...

Fall 2016

Healey, Mark A

α-Synuclein has been implicated in the progression of Parkinson’s disease, a neurodegenerative disorder that affects millions of people worldwide. This work reports on the structural propensity and druggability of this protein using a combination of Monte Carlo, Molecular Dynamics, and Virtual...

1980

Marks, Larry Wayne.

Spring 2019

Gentile, Francesco

Computational methods are nowadays essential tools employed in the field of drug design. Indeed, bringing a molecular compound from bench to clinic is a challenging, time-consuming and expensive goal to achieve. Computer-aided drug design (CADD) techniques aim to simplify this process, by...