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ConfID: an analytical method for conformational characterization of small molecules using molecular dynamics trajectories
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Tutorials
INSTALL.txt
README.md
check_dep.py
confID.py
config
config_help.txt
count_populations.py
count_stay.py
input.inp
populations.py

README.md

ConfID: an analytical method for conformational characterization of small molecules using molecular dynamics trajectories

Thanks for downloading ConfID!

  • For installation instructions, please read "INSTALL.txt"
  • For usage and configuration instructions, please read "config_help.txt"
  • For tutorials and more in depth explanations, please access http://sbcb.inf.ufrgs.br/confid

Have a nice "ConfIDent" analysis! =)

Contact information

Marcelo D. Polêto, Bruno Iochins Grisci, Marcio Dorn, Hugo Verli

  • Centro de Biotecnologia, Universidade Federal do Rio Grande do Sul, Porto Alegre, RS, Brazil
  • Institute of Informatics, Federal University of Rio Grande do Sul, Porto Alegre, RS, Brazil
  • Departamento de Biologia Geral, Universidade Federal de Viçosa, Viçosa, MG, Brazil

E-mail: confidcontact@gmail.com

http://sbcb.inf.ufrgs.br/confid

Citing ConfID

If you use ConfID in a scientific publication, we would appreciate citations to the following paper:

Bibtex entry:

@article{confid,
  title={},
  author={},
  journal={},
  volume={},
  pages={},
  year={},
  publisher={}
}
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