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rggplot2nls

How to find good start values for nls function?


I don't understand why I can't have a nls function for these data. I have tried with a lot of different start values and I have always the same error.

Here is what I have been doing:

expFct2 = function (x, a, b,c)
{
  a*(1-exp(-x/b)) + c  
}
vec_x <- c(77.87,87.76,68.6,66.29)
vec_y <- c(1,1,0.8,0.6)
dt <- data.frame(vec_x=vec_x,vec_y=vec_y)
ggplot(data = dt,aes(x = vec_x, y = vec_y)) +  geom_point() + 
     geom_smooth(data=dt, method="nls", formula=y~expFct2(x, a, b, c),
       se=F, start=list(a=1, b=75, c=-5)

I have always this error:

Error in method(formula, data = data, weights = weight, ...) : 
  singular gradient

Solution

  • This can be written with two linear parameters (.lin1 and .lin2) and one nonlinear parameter (b) like this:

    a*(1-exp(-x/b)) + c  
    = (a+c) - a * exp(-x/b)
    = .lin1 + .lin2 * exp(-x/b)
    

    where .lin1 = a+c and .lin2 = -a (so a = - .lin2 and c = .lin1 + .lin2) This lets us use "plinear" which only requires specification of a starting value for the single nonlinear parameter (eliminating the problem of how to set the starting values for the other parameters) and which converges despite the starting value of b=75 being far from that of the solution:

    nls(y ~ cbind(1, exp(-x/b)), start = list(b = 75), alg = "plinear")
    

    Here is the result of a run from which we can see from the size of .lin2 that the problem is badly scaled:

    > x <- c(77.87,87.76,68.6,66.29)
    > y <- c(1,1,0.8,0.6)
    > nls(y ~ cbind(1, exp(-x/b)), start = list(b = 75), alg = "plinear")
    Nonlinear regression model
      model:  y ~ cbind(1, exp(-x/b)) 
       data:  parent.frame() 
             b      .lin1      .lin2 
     3.351e+00  1.006e+00 -1.589e+08 
     residual sum-of-squares: 7.909e-05
    
    Number of iterations to convergence: 9 
    Achieved convergence tolerance: 9.887e-07 
    > R.version.string
    [1] "R version 2.14.2 Patched (2012-02-29 r58660)"
    > win.version()
    [1] "Windows Vista (build 6002) Service Pack 2"
    

    EDIT: added sample run and comment on scaling.