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Breaking the conformational ensemble barrier: Ensemble structure modeling challenges in CASP15

Kryshtafovych, Andriy et al.
eScholarship · Papers · License: CC BY
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For the first time, the 2022 CASP (Critical Assessment of Structure Prediction) community experiment included a section on computing multiple conformations for protein and RNA structures. There was full or partial success in reproducing the ensembles for four of the nine targets, an encouraging resu
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