The R and R-markdown(.Rmd) files here are meant as in introductory practical example to the functional form of the parts describing energy terms in a force-field.
- Launch in RStudio:
A worksheet in R to illustrate the components of molecular mechanics force-fields.
The R and R-markdown(.Rmd) files here are meant as in introductory practical example to the functional form of the parts describing energy terms in a force-field.
A worksheet in R to illustrate the components of molecular mechanics force-fields.