An Artificial Neural Network Based Approach for Identification of Native Protein Structures using an Extended ForceField

Current protein forcefields like the ones seen in CHARMM or Xplor-NIH have many terms that include bonded and non-bonded terms. Yet the forcefields do not take into account the use of hydrogen bonds which are important for secondary structure creation and stabilization of proteins. SCOPE is an open-...

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Veröffentlicht in:	arXiv.org 2020-03
Hauptverfasser:	Fawcett, Timothy Matthew, Irausquin, Stephanie, Simin, Mikhail, Valafar, Homayoun
Format:	Artikel
Sprache:	eng
Schlagworte:	Artificial neural networks Bond energy Bonding Hydrogen bonds Hydrogen-based energy Neural networks Proteins Quantitative Biology - Biomolecules Quantitative Biology - Quantitative Methods Source programs
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