Evaluating protein-drug interactions with MD and QM

Dnr:

SNIC 2017/1-23

Type:

SNAC Medium

Principal Investigator:

Ran Friedman

Affiliation:

Linnéuniversitetet

Start Date:

2017-02-01

End Date:

2018-02-01

Primary Classification:

10407: Teoretisk kemi

Secondary Classification:

10402: Fysikalisk kemi

Tertiary Classification:

10602: Biokemi och molekylärbiologi

Webpage:

http://lnu.se/ccbg

Allocation

Abstract

The aim of this project is to analyse the binding energies of ligands (drugs) within proteins by use of computational methods.