Buchumschlag

Stereochemical errors and their implications for molecular dynamics simulations

Biological molecules are often asymmetric with respect to stereochemistry, and correct stereochemistry is essential to their function. Molecular dynamics simulations of biomolecules have increasingly become an integral part of biophysical research. However, stereochemical errors in biomolecular stru...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Hauptverfasser: Schreiner, Eduard (VerfasserIn) , Trabuco, Leonardo G. (VerfasserIn) , Freddolino, Peter L. (VerfasserIn) , Schulten, Klaus (VerfasserIn)
Dokumenttyp: Article (Journal)
Sprache:Englisch
Veröffentlicht: 23 May 2011
In: BMC bioinformatics
Year: 2011, Jahrgang: 12, Heft: 1, Pages: 1-9
ISSN:1471-2105
DOI:10.1186/1471-2105-12-190
Online-Zugang:Verlag, lizenzpflichtig, Volltext: https://doi.org/10.1186/1471-2105-12-190
Volltext
Verfasserangaben:Eduard Schreiner, Leonardo G. Trabuco, Peter L. Freddolino and Klaus Schulten
Beschreibung
Zusammenfassung:Biological molecules are often asymmetric with respect to stereochemistry, and correct stereochemistry is essential to their function. Molecular dynamics simulations of biomolecules have increasingly become an integral part of biophysical research. However, stereochemical errors in biomolecular structures can have a dramatic impact on the results of simulations.
Beschreibung:Gesehen am 26.10.2022
Beschreibung:Online Resource
ISSN:1471-2105
DOI:10.1186/1471-2105-12-190

Ähnliche Einträge