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Insight into the Fundamental Interactions between LEDGF Binding Site Inhibitors and Integrase Combining Docking and Molecular Dynamics Simulations.
Laura De Luca
Francesca Morreale
Alba Chimirri
Published in:
J. Chem. Inf. Model. (2012)
Keyphrases
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binding sites
protein protein
protein interaction
protein protein interactions
molecular dynamics simulations
molecular dynamics
computational methods
gene expression
dna sequences
dna binding
hiv protease
high throughput
transcription factors
statistically significant
genome wide
virtual screening