Druggability Assessment of Allosteric Proteins by Dynamics Simulations in the Presence of Probe Molecules
Druggability assessment of a target protein has emerged in recent years as an important concept in hit-to-lead optimization. A reliable and physically relevant measure of druggability would allow informed decisions on the risk of investing in a particular target. Here, we define “druggability” as a...
| Main Authors: | , , , |
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| Format: | Online |
| Language: | English |
| Published: |
American Chemical Society
2012
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| Online Access: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3392909/ |