CHAPERONg

Documentation

A guide to using CHAPERONg... If this is your first time with the code, start here...

Tutorials

A set of tutorials on how to use CHAPERONg.

If you use CHAPERONg in your work please cite it as follows:

Yekeen A. A., Durojaye O. A., Idris M. O., Muritala H. F., & Arise R. O. (2023). CHAPERONg: A tool for automated GROMACS-based molecular dynamics simulations and trajectory analyses, Computational and Structural Biotechnology Journal 21: 4849-4858. [Link][PDF]

For BibTeX, you can insert the following:

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@article {yekeenCSBJ2023chaperong,
	author = {Abeeb Abiodun Yekeen and Olanrewaju Ayodeji Durojaye and Mukhtar Oluwaseun Idris and Hamdalat Folake Muritala and Rotimi Olusanya Arise},
	title = {{CHAPERONg}: A tool for automated {GROMACS}-based molecular dynamics simulations and trajectory analyses},
	journal = {{Computational and Structural Biotechnology Journal}},
	volume = {21},
	pages = {4849-4858},
	year = {2023},
	issn = {2001-0370},
	doi = {https://doi.org/10.1016/j.csbj.2023.09.024},
	publisher = {Elsevier},
	url = {https://www.sciencedirect.com/science/article/pii/S2001037023003367}
}