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Using RosettaLigand for Small Molecule Docking into Comparative Models

Computational small molecule docking into comparative models of proteins is widely used to query protein function and in the development of small molecule therapeutics. We benchmark RosettaLigand docking into comparative models for nine proteins built during CASP8 that contain ligands. We supplement...

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Bibliografiske detaljer
Main Authors: Kaufmann, Kristian W., Meiler, Jens
Format: Artigo
Sprog:Inglês
Udgivet: Public Library of Science 2012
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3519832/
https://ncbi.nlm.nih.gov/pubmed/23239984
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pone.0050769
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