print.nebpath: Print Nudged Elastic Band minima

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

Print Nudged Elastic Band minima

Description

'print.nebpath' prints the list minima for Nudged Elastic Band

Usage

## S3 method for class 'nebpath'
print(x, ...)

Arguments

x	nebpath object
...	further arguments passed to or from other methods.

Examples

tfes<-fes(acealanme, imax=5000)
minima<-fesminima(tfes)
nebAD<-neb(minima, min1="A", min2="D", nsteps=20)
nebAD

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