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MedusaScore: An Accurate Force-Field Based Scoring Function for Virtual Drug Screening

Virtual screening is becoming an important tool for drug discovery. However, the application of virtual screening has been limited by the lack of accurate scoring functions. Here, we present a novel scoring function, MedusaScore, for evaluating protein-ligand binding. MedusaScore is based on models...

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Main Authors: Yin, Shuangye, Biedermannova, Lada, Vondrasek, Jiri, Dokholyan, Nikolay V.
Formato: Artigo
Idioma:Inglês
Publicado: 2008
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC2665000/
https://ncbi.nlm.nih.gov/pubmed/18672869
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci8001167
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