Negative Image-Based Rescoring: Using Cavity Information to Improve Docking Screening.
Sign Up to like & getrecommendations! Published in 2021 at "Methods in molecular biology"
DOI: 10.1007/978-1-0716-1209-5_8
Abstract: Molecular docking produces often lackluster results in real-life virtual screening assays that aim to discover novel drug candidates or hit compounds. The problem lies in the inability of the default docking scoring to properly estimate… read more here.
Keywords: image based; cavity; rescoring using; based rescoring ... See more keywords