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# CITATION file created with {cffr} R package
# See also: https://docs.ropensci.org/cffr/
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cff-version: 1.2.0
message: 'To cite package "bio3d" in publications use:'
type: software
license: GPL-2.0-or-later
title: 'bio3d: Biological Structure Analysis'
version: 2.4-4
identifiers:
- type: doi
  value: 10.32614/CRAN.package.bio3d
abstract: Utilities to process, organize and explore protein structure, sequence and
  dynamics data. Features include the ability to read and write structure, sequence
  and dynamic trajectory data, perform sequence and structure database searches, data
  summaries, atom selection, alignment, superposition, rigid core identification,
  clustering, torsion analysis, distance matrix analysis, structure and sequence conservation
  analysis, normal mode analysis, principal component analysis of heterogeneous structure
  data, and correlation network analysis from normal mode and molecular dynamics data.
  In addition, various utility functions are provided to enable the statistical and
  graphical power of the R environment to work with biological sequence and structural
  data. Please refer to the URLs below for more information.
authors:
- family-names: Grant
  given-names: Barry
  email: bjgrant@ucsd.edu
- family-names: Yao
  given-names: Xin-Qiu
- family-names: Skjaerven
  given-names: Lars
- family-names: Ide
  given-names: Julien
preferred-citation:
  type: article
  title: 'Bio3D: An R package for the comparative analysis of protein structures.'
  authors:
  - family-names: B.J.
    given-names: Grant
  - family-names: A.P.C.
    given-names: Rodrigues
  - family-names: K.M.
    given-names: ElSawy
  - family-names: J.A.
    given-names: McCammon
  - family-names: L.S.D.
    given-names: Caves
  journal: Bioinformatics
  year: '2006'
  volume: '22'
  month: '11'
  start: '2695'
  end: '2696'
repository: https://CRAN.R-project.org/package=bio3d
repository-code: https://bitbucket.org/Grantlab/bio3d/
url: http://thegrantlab.org/bio3d/
date-released: '2022-10-26'
contact:
- family-names: Grant
  given-names: Barry
  email: bjgrant@ucsd.edu