Refinement of protein structures using a combination of quantum-mechanical calculations with neutron and X-ray crystallographic data. Corrigendum.
Octav CaldararuFrancesco ManzoniEsko OksanenDerek T LoganUlf RydePublished in: Acta crystallographica. Section D, Structural biology (2020)
Corrections are published for the article by Caldararu et al. [(2019), Acta Cryst. D75, 368-380].
Keyphrases
- molecular dynamics
- high resolution
- density functional theory
- monte carlo
- electronic health record
- molecular dynamics simulations
- big data
- protein protein
- dual energy
- binding protein
- energy transfer
- mass spectrometry
- magnetic resonance imaging
- small molecule
- electron microscopy
- systematic review
- data analysis
- artificial intelligence