Parameterization of a Dioxygen Binding Metal Site Using the MCPB.py Program

Pengfei Li, Kenneth M. Merz

Research output: Chapter in Book/Report/Conference proceedingChapter

Original languageEnglish
Title of host publicationMethods in Molecular Biology
PublisherHumana Press Inc.
Pages257-275
Number of pages19
DOIs
StatePublished - 2021
Externally publishedYes

Publication series

NameMethods in Molecular Biology
Volume2199
ISSN (Print)1064-3745
ISSN (Electronic)1940-6029

ASJC Scopus Subject Areas

  • Molecular Biology
  • Genetics

Keywords

  • AMBER
  • Force field
  • GROMACS
  • Metal ion
  • Molecular dynamics
  • Software

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