linesonfes {metadynminer} | R Documentation |
Plot lines for Nudged Elastic Band projected onto free energy surface
Description
'linesonfes' plots lines for free energy profile calculated by Nudged Elastic Band projected onto free energy surface.
Usage
linesonfes(x, col = "red", lwd = 1)
Arguments
x |
nebpath object. |
col |
color code or name, see 'par'. |
lwd |
line width for drawing symbols see 'par'. |
Examples
tfes<-fes(acealanme, imax=5000)
minima<-fesminima(tfes)
nebAD<-neb(minima, min1="A", min2="D", nsteps=20)
plot(minima)
linesonfes(nebAD)
[Package metadynminer version 0.1.7 Index]