summary.minima {metadynminer} | R Documentation |
'summary.minima' prints summary for free energy minima (identifier, values of bins and collective variables, free energy and equilibrium populations).
## S3 method for class 'minima'
summary(object, temp = 300, eunit = "kJ/mol", ...)
object |
minima object |
temp |
temperature in Kelvins |
eunit |
energy units (kJ/mol or kcal/mol, kJ/mol is default) |
... |
further arguments passed to or from other methods. |
tfes<-fes(acealanme, imax=5000)
minima<-fesminima(tfes)
summary(minima)