Skip to main content
Incorporation of protein flexibility and conformational energy penalties in docking screens to improve ligand discovery
Published Web Location
http://europepmc.org/articles/PMC4144196?pdf=renderNo data is associated with this publication.
Abstract
Proteins fluctuate between alternative conformations, which presents a challenge for ligand discovery because such flexibility is difficult to treat computationally owing to problems with conformational sampling and energy weighting. Here we describe a fle
Many UC-authored scholarly publications are freely available on this site because of the UC's open access policies. Let us know how this access is important for you.