summary.profiles: Print summary for free energy profile

In metadynminer: Tools to Read, Analyze and Visualize Metadynamics HILLS Files from 'Plumed'

Print summary for free energy profile

Description

'summary.profiles' prints the list of free energy minima with maximal and minimal free energy differences.

Usage

## S3 method for class 'profiles'
summary(object, imind = 1, imaxd = NULL, ...)

Arguments

object	profiles object.
imind	index of a hill from which calculation of difference starts (default 1).
imaxd	index of a hill from which calculation of difference stops (default the rest of hills).
...	further arguments passed to or from other methods.

Examples

tfes<-fes(acealanme, imax=5000)
minima<-fesminima(tfes)
prof<-feprof(minima)
summary(prof)

metadynminer documentation built on April 14, 2022, 5:06 p.m.