ProPose: Steered Virtual Screening by Simultaneous Protein-Ligand Docking and Ligand-Ligand Alignment.

Markus H. J. Seifert

Published in: J. Chem. Inf. Model. (2005)

Keyphrases

virtual screening
drug discovery
similarity searching
chemical structures
ligand docking
high throughput
scoring function
binding sites
similarity search
drug design
chemical compounds
scientific data
systems biology
biologically inspired
dna sequences
metric space
complex systems
data management