19.2 – Bootstrap sampling

Introduction

Bootstrapping is a general approach to estimation or statistical inference that utilizes random sampling with replacement (Kulesa et al. 2015).  In classic frequentist approach, a sample is drawn at random from the population and assumptions about the population distribution are made in order to conduct statistical inference. By resampling with replacement from the sample many times, the bootstrap samples can be viewed as if we drew from the population many times without invoking a theoretical distribution. A clear advantage of the bootstrap is that it allows estimation of confidence intervals without assuming a particular theoretical distribution and thus avoids the burden of repeating the experiment.

Base install of R includes the boot package.  The boot package allows R users to work with most functions, and many authors have provided helpful packages. I highlight a couple packages

install packages lmboot, confintr

Example data set, Tadpoles from Chapter 14, copied to end of this page for convenience (scroll down or click here).

Bootstrapped 95% Confidence interval of population mean

Recall classic frequentist (large-sample) approach to confidence interval estimates of mean by R

x = round(mean(Tadpole$Body.mass),2); x 
n = length(Tadpole$Body.mass); n
s = sd(Tadpole$Body.mass); s
error = qt(0.975,df=n-1)*(s/sqrt(n)); error
lower_ci = round(x-error,3)
upper_ci = round(x+error,3)
paste("95% CI of ", x, " between:", lower_ci, "&", upper_ci)

Output results are

> n = length(Tadpole$Body.mass); n 
[1] 13
> s = sd(Tadpole$Body.mass); s 
[1] 0.6366207
> error = qt(0.975,df=n-1)*(s/sqrt(n)); error 
[1] 0.384706
> paste("95% CI of ", x, " between:", lower_ci, "&", upper_ci)
[1] "95% CI of 2.41 between: 2.025 & 2.795"

We used the t-distribution because both \mu the population mean and \sigma the population standard deviation were unknown. Thus, 95 out of 100 confidence intervals would be expected to include the true value.

Bootstrap equivalent

library(confintr)
ci_mean(Tadpole$Body.mass, type=c("bootstrap"), boot_type=c("stud"), R=999, probs=c(0.025, 0.975), seed=1)

Output results are

Two-sided 95% bootstrap confidence interval for the population mean based on 999 bootstrap replications
and the student method

Sample estimate: 2.412308 
Confidence interval:
    2.5%    97.5% 
2.075808 2.880144

where stud is short for student t distribution (another common option is the percentile method — replace stud with perc), R = 999 directs the function to resample 999 times. We set seed=1 to initialize the pseudorandom number generator so that if we run the command again, we would get the same result. Any integer number can be used. For example, I set seed = 1 for output below

Confidence interval:
    2.5%    97.5% 
2.075808 2.880144

compared to repeated runs without initializing the pseudorandom number generator:

Confidence interval:
    2.5%    97.5% 
2.067558 2.934055

and again

Confidence interval:
    2.5%    97.5% 
2.067616 2.863158

Note that the classic confidence interval is narrower than the bootstrap estimate, in part because of the small sample size (i.e., not as accurate, does not actually achieve the nominal 95% coverage). Which to use? The sample size was small, just 13 tadpoles. Bootstrap samples were drawn from the original data set, thus it cannot make a small study more robust. The 999 samples can be thought as estimating the sampling distribution. If the assumptions of the t-distribution hold, then the classic approach would be preferred. For the Tadpole data set, Body.mass was approximately normally distributed (Anderson-Darling test = 0.21179, p-value = 0.8163). For cases where assumption of a particular distribution is unwarranted (e.g., what is the appropriate distribution when we compare medians among samples?), bootstrap may be preferred (and for small data sets, percentile bootstrap may be better). To complete the analysis, percentile bootstrap estimate of confidence interval are presented.

The R code

ci_mean(Tadpole$Body.mass, type=c("bootstrap"), boot_type=c("perc"), R=999, probs=c(0.025, 0.975), seed=1)

and the output

Two-sided 95% bootstrap confidence interval for the population mean based on 999 bootstrap replications
and the percent method

Sample estimate: 2.412308 
Confidence interval:
    2.5%    97.5% 
2.076923 2.749231

In this case, the bootstrap percentile confidence interval is narrower than the frequentist approach.

Model coefficients by bootstrap

R code

Enter the model, then set B, the number of samples with replacement.

myBoot <- residual.boot(VO2~Body.mass, B = 1000, data = Tadpoles)

R returns two values:

  1. bootEstParam, which are the bootstrap parameter estimates. Each column in the matrix lists the values for a coefficient. For this model, bootEstParam$[,1] is the intercept and bootEstParam$[,2] is the slope.
  2. origEstParam, a vector with the original parameter estimates for the model coefficients.
  3. seed, numerical value for the seed; use seed number to get reproducible results. If you don’t specify the seed, then seed is set to pick any random number.

While you can list the $bootEstParam, not advisable because it will be a list of 1000 numbers (the value set with B)!

Get necessary statistics and plots

#95% CI slope
quantile(myBoot$bootEstParam[,2], probs=c(.025, .975))

R returns

    2.5%    97.5% 
335.0000 562.6228
#95% CI intercept
quantile(myBoot$bootEstParam[,1], probs=c(.025, .975))

R returns

     2.5%     97.5% 
-881.3893 -310.8209

Slope

#plot the sampling distribution of the slope coefficient
par(mar=c(5,5,5,5)) #setting margins to my preferred values
hist(myBoot$bootEstParam[,2], col="blue", main="Bootstrap Sampling Distribution",
xlab="Slope Estimate")

histogram bootstrap estimates slope

Figure 1. histogram of bootstrap estimates for slope

Intercept

#95% CI intercept
quantile(myBoot$bootEstParam[,1], probs=c(.025, .975))
par(mar=c(5,5,5,5))
hist(myBoot$bootEstParam[,1], col="blue", main="Bootstrap Sampling Distribution",
xlab="Intercept Estimate")

Histogram bootstrap estimates

Figure 2. Histogram of bootstrap estimates for intercept.

Questions

edits: pending

 

Data set used this page (sorted)

Gosner Body mass VO2
I 1.76 109.41
I 1.88 329.06
I 1.95 82.35
I 2.13 198
I 2.26 607.7
II 2.28 362.71
II 2.35 556.6
II 2.62 612.93
II 2.77 514.02
II 2.97 961.01
II 3.14 892.41
II 3.79 976.97
NA 1.46 170.91

Chapter 19 contents

6.6 – Continuous distributions

Large numbers and the Central Limit Theorem

Imagine we’ve collected (sampled) data from a population and now want to summarize the data sample. How do we proceed? A good starting point is to plot the data in a histogram and note the shape of the sample distribution. Not to get too far ahead of ourselves here, but much of the classical inferential statistics demands that we are able to assume that the sampled values come from a certain kind of distribution called the normal, or Gaussian distribution.

Consider a random sample drawn from a normally distributed population of the following series of graphs, Figures 1 – 4:

n = 20

Figure 1. Sample size = 20, drawn from population with known μ = 0 and σ = 1.

n = 100

Figure 2. Sample size = 100, also drawn from population with known μ = 0 and σ = 1.

n = 1000

Figure 3. Sample size n = 1000, once again drawn from population with known μ = 0 and σ = 1.

n = one million

Figure 4. And lastly, sample size n = 1 million also drawn from population with known μ = 0 and σ = 1.

These graphs illustrate a fundamental point in statistics: for many kinds of measurements in biology, the more data you sample, the more likely the data will approach a normal distribution. This series of simulations was a quick and dirty “proof” of the Central Limit Theorem, which is one of the two fundamental theorems of probability, the other being that of Law of Large Numbers (ie, large-sample statistics). Basically the CLT says that for a large number of random samples, the sample mean will approach the population mean,  μ, and the sample variance will approach the population variance σ2; the distribution of the large sample will converge on the normal distribution.

As the sample size gets bigger and bigger, the resulting sample means and standard deviations get closer and closer to the true value (remember — I TOLD the program to grab numbers from the Z distribution with a mean of zero and standard deviation = 1), obeying the Law of Large Numbers.

Simulation

I used the computer to generate sample data from a population. This process is called a simulation. R can make new data sets by sampling from known populations with specified distribution properties that we determine in advance — a very powerful tool — a technique used for many kinds of statistics (eg, Monte Carlo methods, bootstrapping, etc., see Chapter 19).

Note 1: How I got the data. All of these data are from a simulation where I asked told R, “grab random numbers from an infinitely large population, with mean = 0 and standard deviation = 1.”

  1. The first graph is for a sample of 20 points;
  2. the second for 100;
  3. the third for 1,000;
  4. and lastly, 1 million points.

To generate a sample from a normal population, the Rcmdr call the menu by selecting:

Rcmdr: Distributions → Continuous distributions → Normal distribution → Sample from normal distribution…

Rcmdr menu: sample from normal distribution

Figure 5. Screenshot Rcmdr menu, sample from a normal distribution.

The menu pops up. I entered Mean (μ) = 0 and Standard deviation (σ) = 1 number of samples = 10, unchecked all boxes under the “add to data set.” I left the object name as “NormalSamples,” you can, of course, change it as needed. R code derived from these requests were

normalityTest(~obs, test="shapiro.test", data=NormalSamples)
NormalSamples <- as.data.frame(matrix(rnorm(10*1, mean=0, sd=1), ncol=1))
rownames(NormalSamples) <- paste("sample", 1:10, sep="")
colnames(NormalSamples) <- "obs"

This results in a new data.frame called NormalSamples with a single variable called obs.

Note 2: About pseudorandom number generator, PRNG. An algorithm is used for creating a sequence of numbers that are like random numbers. We say “like” or “pseudo” random numbers because the algorithm requires a starting number called the seed, rather than a truly random process, ie, a source of entropy outside of the computer. The default PRNG algorithm in base R is Mersenne Twister (Wikipedia), though there are many others included in base R (bring up the help menu by typing ?RNGkind at the prompt), as well as other packages, like random, which can be used to generate truly random numbers (source of entropy is “atmospheric noise,” per citation in the package, see also random.org).

rnorm() was the function used to sample from a normal distribution. If you run the function over and over again (eg, use a for loop), each time you will get different samples. For example, results from three runs

for (i in 1:3){
print(rnorm(5))
}
[1] -0.4221672 -1.4317800 -1.8310352 0.4181184 -1.1596058
[1] -0.2034944 1.1809083 1.5925296 -2.0763677 1.6982357
[1] -1.0967218 -0.3205041 -1.7513838 -0.3335311 -1.8808454

However, if you set the seed to the same number before calling rnorm, you’ll get the same sampled numbers.

for (i in 1:3){
set.seed(1) 
print(rnorm(5))
}
[1] -0.6264538 0.1836433 -0.8356286 1.5952808 0.3295078
[1] -0.6264538 0.1836433 -0.8356286 1.5952808 0.3295078
[1] -0.6264538 0.1836433 -0.8356286 1.5952808 0.3295078

The seed number can be any number, it does not have to equal 1.

After creating a sample of numbers drawn from the normal distribution, make a histogram, Rcmdr: Graphs → Histogram… (see Chapter 4.2).

The normal distribution

More on the importance of normal curves in a moment. Sometimes people call these “bell-shaped” curves. You may also see such distributions referred to as Gaussian Distributions, but the normal curve is but one of many Gaussian -type distributions. Moreover, not all “bell-shaped” curves are NORMAL. For a distribution to be “normally distributed” it must follow a specific formula.

    \begin{align*} Y_{i} = \frac{1}{\sigma \sqrt{2\pi}} e^{\frac{-\left (X_{i}-\mu \right )^2}{2\sigma^2}} \end{align*}

This formula has a lot of parts, but once we break down the parts, we’ll see that there is just two things to know. First, let’s identify the parts of the equation:

Y_{i} is the height of the curve (normal density)
\pi (pie) is a constant = 3.14159… (R, use pi)
µ is the population mean
σ2 is the population variance
σ is the square-root of the variance or the population standard deviation
e is the natural logarithm (R, use exp())
X_{i} is the individual’s value

Why the Normal distribution is so important in classical statistics

With these distinctions out of the way, the first important message about the normal curve is that it permits us to say how likely (ie, how probable) is a particular value if the observation comes from a population with mean µ and standard deviation σ and the population from which the sample was drawn came from a normal distribution.

The second message: all we need to know to recreate the normal distribution for a set of data is the mean and the variance (or the standard deviation) for the population!! With just these two parameters, we can then determine the expected proportion of observations expected for each value of X. Note — we generally do not know these two because they are population parameters: we must estimate them from samples, using our sample statistics, and that’s where the first big assumption in conducting statistical analyses comes into play!!

An example for calculating the normal distribution when knowing the mean and variance

µ = 5, σ2 = 10 (thus, the standard deviation, σ = 3.16)

The formula becomes

    \begin{align*} Y_{i} = \frac{0.398947}{3.16} e^{\frac{-\left (X_{i}-5 \right )^2}{2\cdot 10}} \end{align*}

Now, plug in different values of X (for example, what’s the probability that a value of X could be 0, 1, 2, …, 10? If we really do have a normal curve with mean = 5, and variance = 10).

The normal equation returns the proportion of observations in a normal population for each X value:

When i = 5 Y5 = 0.12616 This is the proportion of all data points that have an X = 5 When i = 1 Y1 = 0.019995 This is the proportion of all data points that have an X = 1

We can keep going, getting the proportion expected for each value of X, then make the plot (Fig 6).

some normal points

Figure 6. Frequency expected for a few points (X: 0 – 10) drawn from a normal distribution, calculated using the formula and example values. 

Here’s the R code for the plot

X = seq(0,10, by=1)
Y = (0.398947/3.16)*exp((-1*(X-5)^2)/20)
plot(Y~X, ylab="Frequency (Y)", cex=1.5, pch=19,col="blue")
lines(X,Y, col="blue", lwd=2)

Next up, more about the normal distribution, Chapter 6.7.

Questions

  1. For a mean of 0 and standard deviation of 1, apply the equation for the normal curve for X = (-4, -3.5, -3, -2.5, -2, -1.5, -1, -0.5, 0, 0.5, 1, 1.5, 2, 2.5, 3, 3.5, 4). Plot your results.
  2. Sample from a normal distribution with different sample size, means, and standard deviations, each time make a histogram and compare the shape of the histograms.
  3. For  a subset of

Quiz Chapter 6.6

Continuous distributions


Chapter 6 contents