Modeling censored information with tfprobability

Nothing’s ever excellent, and information isn’t both. One sort of “imperfection” is lacking information, the place some options are unobserved for some topics. (A subject for an additional put up.) One other is censored information, the place an occasion whose traits we wish to measure doesn’t happen within the statement interval. The instance in Richard McElreath’s Statistical Rethinking is time to adoption of cats in an animal shelter. If we repair an interval and observe wait instances for these cats that truly did get adopted, our estimate will find yourself too optimistic: We don’t bear in mind these cats who weren’t adopted throughout this interval and thus, would have contributed wait instances of size longer than the entire interval.

On this put up, we use a barely much less emotional instance which nonetheless could also be of curiosity, particularly to R package deal builders: time to completion of R CMD verify, collected from CRAN and supplied by the parsnip package deal as check_times. Right here, the censored portion are these checks that errored out for no matter motive, i.e., for which the verify didn’t full.

Why will we care concerning the censored portion? Within the cat adoption state of affairs, that is fairly apparent: We wish to have the ability to get a sensible estimate for any unknown cat, not simply these cats that may grow to be “fortunate”. How about check_times? Properly, in case your submission is a type of that errored out, you continue to care about how lengthy you wait, so though their share is low (< 1%) we don’t wish to merely exclude them. Additionally, there may be the chance that the failing ones would have taken longer, had they run to completion, as a result of some intrinsic distinction between each teams. Conversely, if failures have been random, the longer-running checks would have a larger probability to get hit by an error. So right here too, exluding the censored information might end in bias.

How can we mannequin durations for that censored portion, the place the “true length” is unknown? Taking one step again, how can we mannequin durations normally? Making as few assumptions as attainable, the most entropy distribution for displacements (in area or time) is the exponential. Thus, for the checks that truly did full, durations are assumed to be exponentially distributed.

For the others, all we all know is that in a digital world the place the verify accomplished, it could take a minimum of as lengthy because the given length. This amount may be modeled by the exponential complementary cumulative distribution perform (CCDF). Why? A cumulative distribution perform (CDF) signifies the likelihood {that a} worth decrease or equal to some reference level was reached; e.g., “the likelihood of durations <= 255 is 0.9”. Its complement, 1 – CDF, then provides the likelihood {that a} worth will exceed than that reference level.

Let’s see this in motion.

The info

The next code works with the present steady releases of TensorFlow and TensorFlow Chance, that are 1.14 and 0.7, respectively. In case you don’t have tfprobability put in, get it from Github:

These are the libraries we’d like. As of TensorFlow 1.14, we name tf$compat$v2$enable_v2_behavior() to run with keen execution.

In addition to the verify durations we wish to mannequin, check_times reviews numerous options of the package deal in query, corresponding to variety of imported packages, variety of dependencies, dimension of code and documentation information, and many others. The standing variable signifies whether or not the verify accomplished or errored out.

df <- check_times %>% choose(-package deal)
glimpse(df)

Observations: 13,626
Variables: 24
$ authors         1, 1, 1, 1, 5, 3, 2, 1, 4, 6, 1, 2, 1, 1, 1, 1, 1, 1, 1, 1,…
$ imports         0, 6, 0, 0, 3, 1, 0, 4, 0, 7, 0, 0, 0, 0, 3, 2, 14, 2, 2, 0…
$ suggests        2, 4, 0, 0, 2, 0, 2, 2, 0, 0, 2, 8, 0, 0, 2, 0, 1, 3, 0, 0,…
$ relies upon         3, 1, 6, 1, 1, 1, 5, 0, 1, 1, 6, 5, 0, 0, 0, 1, 1, 5, 0, 2,…
$ Roxygen         0, 1, 0, 0, 1, 0, 0, 1, 0, 0, 1, 0, 1, 0, 1, 0, 1, 1, 1, 0,…
$ gh              0, 1, 0, 0, 0, 0, 0, 1, 0, 0, 1, 0, 0, 0, 1, 0, 1, 0, 0, 0,…
$ rforge          0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0,…
$ descr           217, 313, 269, 63, 223, 1031, 135, 344, 204, 335, 104, 163,…
$ r_count         2, 20, 8, 0, 10, 10, 16, 3, 6, 14, 16, 4, 1, 1, 11, 5, 7, 1…
$ r_size          0.029053, 0.046336, 0.078374, 0.000000, 0.019080, 0.032607,…
$ ns_import       3, 15, 6, 0, 4, 5, 0, 4, 2, 10, 5, 6, 1, 0, 2, 2, 1, 11, 0,…
$ ns_export       0, 19, 0, 0, 10, 0, 0, 2, 0, 9, 3, 4, 0, 1, 10, 0, 16, 0, 2…
$ s3_methods      3, 0, 11, 0, 0, 0, 0, 2, 0, 23, 0, 0, 2, 5, 0, 4, 0, 0, 0, …
$ s4_methods      0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0,…
$ doc_count       0, 3, 1, 0, 1, 0, 0, 0, 0, 0, 0, 0, 0, 0, 1, 0, 0, 0, 0, 0,…
$ doc_size        0.000000, 0.019757, 0.038281, 0.000000, 0.007874, 0.000000,…
$ src_count       0, 0, 0, 0, 0, 0, 0, 2, 0, 5, 3, 0, 0, 0, 0, 0, 0, 54, 0, 0…
$ src_size        0.000000, 0.000000, 0.000000, 0.000000, 0.000000, 0.000000,…
$ data_count      2, 0, 0, 3, 3, 1, 10, 0, 4, 2, 2, 146, 0, 0, 0, 0, 0, 10, 0…
$ data_size       0.025292, 0.000000, 0.000000, 4.885864, 4.595504, 0.006500,…
$ testthat_count  0, 8, 0, 0, 0, 0, 0, 1, 0, 0, 0, 0, 0, 0, 0, 0, 3, 3, 0, 0,…
$ testthat_size   0.000000, 0.002496, 0.000000, 0.000000, 0.000000, 0.000000,…
$ check_time      49, 101, 292, 21, 103, 46, 78, 91, 47, 196, 200, 169, 45, 2…
$ standing          1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1,…

Of those 13,626 observations, simply 103 are censored:

0     1 
103 13523 

For higher readability, we’ll work with a subset of the columns. We use surv_reg to assist us discover a helpful and attention-grabbing subset of predictors:

survreg_fit <-
  surv_reg(dist = "exponential") %>% 
  set_engine("survreg") %>% 
  match(Surv(check_time, standing) ~ ., 
      information = df)
tidy(survreg_fit) 

# A tibble: 23 x 7
   time period             estimate std.error statistic  p.worth conf.low conf.excessive
                                         
 1 (Intercept)     3.86      0.0219     176.     0.             NA        NA
 2 authors         0.0139    0.00580      2.40   1.65e- 2       NA        NA
 3 imports         0.0606    0.00290     20.9    7.49e-97       NA        NA
 4 suggests        0.0332    0.00358      9.28   1.73e-20       NA        NA
 5 relies upon         0.118     0.00617     19.1    5.66e-81       NA        NA
 6 Roxygen         0.0702    0.0209       3.36   7.87e- 4       NA        NA
 7 gh              0.00898   0.0217       0.414  6.79e- 1       NA        NA
 8 rforge          0.0232    0.0662       0.351  7.26e- 1       NA        NA
 9 descr           0.000138  0.0000337    4.10   4.18e- 5       NA        NA
10 r_count         0.00209   0.000525     3.98   7.03e- 5       NA        NA
11 r_size          0.481     0.0819       5.87   4.28e- 9       NA        NA
12 ns_import       0.00352   0.000896     3.93   8.48e- 5       NA        NA
13 ns_export      -0.00161   0.000308    -5.24   1.57e- 7       NA        NA
14 s3_methods      0.000449  0.000421     1.06   2.87e- 1       NA        NA
15 s4_methods     -0.00154   0.00206     -0.745  4.56e- 1       NA        NA
16 doc_count       0.0739    0.0117       6.33   2.44e-10       NA        NA
17 doc_size        2.86      0.517        5.54   3.08e- 8       NA        NA
18 src_count       0.0122    0.00127      9.58   9.96e-22       NA        NA
19 src_size       -0.0242    0.0181      -1.34   1.82e- 1       NA        NA
20 data_count      0.0000415 0.000980     0.0423 9.66e- 1       NA        NA
21 data_size       0.0217    0.0135       1.61   1.08e- 1       NA        NA
22 testthat_count -0.000128  0.00127     -0.101  9.20e- 1       NA        NA
23 testthat_size   0.0108    0.0139       0.774  4.39e- 1       NA        NA

Plainly if we select imports, relies upon, r_size, doc_size, ns_import and ns_export we find yourself with a mixture of (comparatively) highly effective predictors from completely different semantic areas and of various scales.

Earlier than pruning the dataframe, we save away the goal variable. In our mannequin and coaching setup, it’s handy to have censored and uncensored information saved individually, so right here we create two goal matrices as an alternative of 1:

# verify instances for failed checks
# _c stands for censored
check_time_c <- df %>%
  filter(standing == 0) %>%
  choose(check_time) %>%
  as.matrix()

# verify instances for profitable checks 
check_time_nc <- df %>%
  filter(standing == 1) %>%
  choose(check_time) %>%
  as.matrix()

Now we are able to zoom in on the variables of curiosity, establishing one dataframe for the censored information and one for the uncensored information every. All predictors are normalized to keep away from overflow throughout sampling. We add a column of 1s to be used as an intercept.

df <- df %>% choose(standing,
                    relies upon,
                    imports,
                    doc_size,
                    r_size,
                    ns_import,
                    ns_export) %>%
  mutate_at(.vars = 2:7, .funs = perform(x) (x - min(x))/(max(x)-min(x))) %>%
  add_column(intercept = rep(1, nrow(df)), .earlier than = 1)

# dataframe of predictors for censored information  
df_c <- df %>% filter(standing == 0) %>% choose(-standing)
# dataframe of predictors for non-censored information 
df_nc <- df %>% filter(standing == 1) %>% choose(-standing)

That’s it for preparations. However after all we’re curious. Do verify instances look completely different? Do predictors – those we selected – look completely different?

Evaluating a couple of significant percentiles for each lessons, we see that durations for uncompleted checks are greater than these for accomplished checks all through, aside from the 100% percentile. It’s not stunning that given the large distinction in pattern dimension, most length is greater for accomplished checks. In any other case although, doesn’t it seem like the errored-out package deal checks “have been going to take longer”?

How concerning the predictors? We don’t see any variations for relies upon, the variety of package deal dependencies (aside from, once more, the upper most reached for packages whose verify accomplished):

However for all others, we see the identical sample as reported above for check_time. Variety of packages imported is greater for censored information in any respect percentiles apart from the utmost:

Similar for ns_export, the estimated variety of exported capabilities or strategies:

In addition to for ns_import, the estimated variety of imported capabilities or strategies:

Similar sample for r_size, the scale on disk of information within the R listing:

And eventually, we see it for doc_size too, the place doc_size is the scale of .Rmd and .Rnw information:

Given our process at hand – mannequin verify durations taking into consideration uncensored in addition to censored information – we received’t dwell on variations between each teams any longer; nonetheless we thought it attention-grabbing to narrate these numbers.

So now, again to work. We have to create a mannequin.

The mannequin

As defined within the introduction, for accomplished checks length is modeled utilizing an exponential PDF. That is as simple as including tfd_exponential() to the mannequin perform, tfd_joint_distribution_sequential(). For the censored portion, we’d like the exponential CCDF. This one is just not, as of in the present day, simply added to the mannequin. What we are able to do although is calculate its worth ourselves and add it to the “essential” mannequin probability. We’ll see this under when discussing sampling; for now it means the mannequin definition finally ends up simple because it solely covers the non-censored information. It’s fabricated from simply the mentioned exponential PDF and priors for the regression parameters.

As for the latter, we use 0-centered, Gaussian priors for all parameters. Customary deviations of 1 turned out to work properly. Because the priors are all the identical, as an alternative of itemizing a bunch of tfd_normals, we are able to create them unexpectedly as

tfd_sample_distribution(tfd_normal(0, 1), sample_shape = 7)

Imply verify time is modeled as an affine mixture of the six predictors and the intercept. Right here then is the entire mannequin, instantiated utilizing the uncensored information solely:

mannequin <- perform(information) {
  tfd_joint_distribution_sequential(
    checklist(
      tfd_sample_distribution(tfd_normal(0, 1), sample_shape = 7),
      perform(betas)
        tfd_independent(
          tfd_exponential(
            fee = 1 / tf$math$exp(tf$transpose(
              tf$matmul(tf$forged(information, betas$dtype), tf$transpose(betas))))),
          reinterpreted_batch_ndims = 1)))
}

m <- mannequin(df_nc %>% as.matrix())

At all times, we take a look at if samples from that mannequin have the anticipated shapes:

samples <- m %>% tfd_sample(2)
samples

[[1]]
tf.Tensor(
[[ 1.4184642   0.17583323 -0.06547955 -0.2512014   0.1862184  -1.2662812
   1.0231884 ]
 [-0.52142304 -1.0036682   2.2664437   1.29737     1.1123234   0.3810004
   0.1663677 ]], form=(2, 7), dtype=float32)

[[2]]
tf.Tensor(
[[4.4954767  7.865639   1.8388556  ... 7.914391   2.8485563  3.859719  ]
 [1.549662   0.77833986 0.10015647 ... 0.40323067 3.42171    0.69368565]], form=(2, 13523), dtype=float32)

This appears high-quality: We’ve got an inventory of size two, one aspect for every distribution within the mannequin. For each tensors, dimension 1 displays the batch dimension (which we arbitrarily set to 2 on this take a look at), whereas dimension 2 is 7 for the variety of regular priors and 13523 for the variety of durations predicted.

How possible are these samples?

m %>% tfd_log_prob(samples)

tf.Tensor([-32464.521   -7693.4023], form=(2,), dtype=float32)

Right here too, the form is appropriate, and the values look cheap.

The following factor to do is outline the goal we wish to optimize.

Optimization goal

Abstractly, the factor to maximise is the log probility of the info – that’s, the measured durations – below the mannequin.
Now right here the info is available in two elements, and the goal does as properly. First, we’ve the non-censored information, for which

m %>% tfd_log_prob(checklist(betas, tf$forged(target_nc, betas$dtype)))

will calculate the log likelihood. Second, to acquire log likelihood for the censored information we write a customized perform that calculates the log of the exponential CCDF:

get_exponential_lccdf <- perform(betas, information, goal) {
  e <-  tfd_independent(tfd_exponential(fee = 1 / tf$math$exp(tf$transpose(tf$matmul(
    tf$forged(information, betas$dtype), tf$transpose(betas)
  )))),
  reinterpreted_batch_ndims = 1)
  cum_prob <- e %>% tfd_cdf(tf$forged(goal, betas$dtype))
  tf$math$log(1 - cum_prob)
}

Each elements are mixed in a bit of wrapper perform that enables us to check coaching together with and excluding the censored information. We received’t do this on this put up, however you is likely to be to do it with your individual information, particularly if the ratio of censored and uncensored elements is rather less imbalanced.

get_log_prob <-
  perform(target_nc,
           censored_data = NULL,
           target_c = NULL) {
    log_prob <- perform(betas) {
      log_prob <-
        m %>% tfd_log_prob(checklist(betas, tf$forged(target_nc, betas$dtype)))
      potential <-
        if (!is.null(censored_data) && !is.null(target_c))
          get_exponential_lccdf(betas, censored_data, target_c)
      else
        0
      log_prob + potential
    }
    log_prob
  }

log_prob <-
  get_log_prob(
    check_time_nc %>% tf$transpose(),
    df_c %>% as.matrix(),
    check_time_c %>% tf$transpose()
  )

Sampling

With mannequin and goal outlined, we’re able to do sampling.

n_chains <- 4
n_burnin <- 1000
n_steps <- 1000

# preserve monitor of some diagnostic output, acceptance and step dimension
trace_fn <- perform(state, pkr) {
  checklist(
    pkr$inner_results$is_accepted,
    pkr$inner_results$accepted_results$step_size
  )
}

# get form of preliminary values 
# to begin sampling with out producing NaNs, we'll feed the algorithm
# tf$zeros_like(initial_betas)
# as an alternative 
initial_betas <- (m %>% tfd_sample(n_chains))[[1]]

For the variety of leapfrog steps and the step dimension, experimentation confirmed {that a} mixture of 64 / 0.1 yielded cheap outcomes:

hmc <- mcmc_hamiltonian_monte_carlo(
  target_log_prob_fn = log_prob,
  num_leapfrog_steps = 64,
  step_size = 0.1
) %>%
  mcmc_simple_step_size_adaptation(target_accept_prob = 0.8,
                                   num_adaptation_steps = n_burnin)

run_mcmc <- perform(kernel) {
  kernel %>% mcmc_sample_chain(
    num_results = n_steps,
    num_burnin_steps = n_burnin,
    current_state = tf$ones_like(initial_betas),
    trace_fn = trace_fn
  )
}

# vital for efficiency: run HMC in graph mode
run_mcmc <- tf_function(run_mcmc)

res <- hmc %>% run_mcmc()
samples <- res$all_states

Outcomes

Earlier than we examine the chains, here’s a fast have a look at the proportion of accepted steps and the per-parameter imply step dimension:

0.995

0.004953894

We additionally retailer away efficient pattern sizes and the rhat metrics for later addition to the synopsis.

effective_sample_size <- mcmc_effective_sample_size(samples) %>%
  as.matrix() %>%
  apply(2, imply)
potential_scale_reduction <- mcmc_potential_scale_reduction(samples) %>%
  as.numeric()

We then convert the samples tensor to an R array to be used in postprocessing.

# 2-item checklist, the place every merchandise has dim (1000, 4)
samples <- as.array(samples) %>% array_branch(margin = 3)

How properly did the sampling work? The chains combine properly, however for some parameters, autocorrelation remains to be fairly excessive.

prep_tibble <- perform(samples) {
  as_tibble(samples,
            .name_repair = ~ c("chain_1", "chain_2", "chain_3", "chain_4")) %>%
    add_column(pattern = 1:n_steps) %>%
    collect(key = "chain", worth = "worth",-pattern)
}

plot_trace <- perform(samples) {
  prep_tibble(samples) %>%
    ggplot(aes(x = pattern, y = worth, colour = chain)) +
    geom_line() +
    theme_light() +
    theme(
      legend.place = "none",
      axis.title = element_blank(),
      axis.textual content = element_blank(),
      axis.ticks = element_blank()
    )
}

plot_traces <- perform(samples) {
  plots <- purrr::map(samples, plot_trace)
  do.name(grid.organize, plots)
}

plot_traces(samples)

Determine 1: Hint plots for the 7 parameters.

Now for a synopsis of posterior parameter statistics, together with the same old per-parameter sampling indicators efficient pattern dimension and rhat.

all_samples <- map(samples, as.vector)

means <- map_dbl(all_samples, imply)

sds <- map_dbl(all_samples, sd)

hpdis <- map(all_samples, ~ hdi(.x) %>% t() %>% as_tibble())

abstract <- tibble(
  imply = means,
  sd = sds,
  hpdi = hpdis
) %>% unnest() %>%
  add_column(param = colnames(df_c), .after = FALSE) %>%
  add_column(
    n_effective = effective_sample_size,
    rhat = potential_scale_reduction
  )

abstract

# A tibble: 7 x 7
  param       imply     sd  decrease higher n_effective  rhat
                     
1 intercept  4.05  0.0158  4.02   4.08       508.   1.17
2 relies upon    1.34  0.0732  1.18   1.47      1000    1.00
3 imports    2.89  0.121   2.65   3.12      1000    1.00
4 doc_size   6.18  0.394   5.40   6.94       177.   1.01
5 r_size     2.93  0.266   2.42   3.46       289.   1.00
6 ns_import  1.54  0.274   0.987  2.06       387.   1.00
7 ns_export -0.237 0.675  -1.53   1.10        66.8  1.01

Determine 2: Posterior means and HPDIs.

From the diagnostics and hint plots, the mannequin appears to work fairly properly, however as there is no such thing as a simple error metric concerned, it’s laborious to know if precise predictions would even land in an acceptable vary.

To ensure they do, we examine predictions from our mannequin in addition to from surv_reg.
This time, we additionally break up the info into coaching and take a look at units. Right here first are the predictions from surv_reg:

train_test_split <- initial_split(check_times, strata = "standing")
check_time_train <- coaching(train_test_split)
check_time_test <- testing(train_test_split)

survreg_fit <-
  surv_reg(dist = "exponential") %>% 
  set_engine("survreg") %>% 
  match(Surv(check_time, standing) ~ relies upon + imports + doc_size + r_size + 
        ns_import + ns_export, 
      information = check_time_train)
survreg_fit(sr_fit)

# A tibble: 7 x 7
  time period         estimate std.error statistic  p.worth conf.low conf.excessive
                                    
1 (Intercept)  4.05      0.0174     234.    0.             NA        NA
2 relies upon      0.108     0.00701     15.4   3.40e-53       NA        NA
3 imports      0.0660    0.00327     20.2   1.09e-90       NA        NA
4 doc_size     7.76      0.543       14.3   2.24e-46       NA        NA
5 r_size       0.812     0.0889       9.13  6.94e-20       NA        NA
6 ns_import    0.00501   0.00103      4.85  1.22e- 6       NA        NA
7 ns_export   -0.000212  0.000375    -0.566 5.71e- 1       NA        NA

survreg_pred <- 
  predict(survreg_fit, check_time_test) %>% 
  bind_cols(check_time_test %>% choose(check_time, standing))  

ggplot(survreg_pred, aes(x = check_time, y = .pred, colour = issue(standing))) +
  geom_point() + 
  coord_cartesian(ylim = c(0, 1400))

Determine 3: Take a look at set predictions from surv_reg. One outlier (of worth 160421) is excluded by way of coord_cartesian() to keep away from distorting the plot.

For the MCMC mannequin, we re-train on simply the coaching set and acquire the parameter abstract. The code is analogous to the above and never proven right here.

We are able to now predict on the take a look at set, for simplicity simply utilizing the posterior means:

df <- check_time_test %>% choose(
                    relies upon,
                    imports,
                    doc_size,
                    r_size,
                    ns_import,
                    ns_export) %>%
  add_column(intercept = rep(1, nrow(check_time_test)), .earlier than = 1)

mcmc_pred <- df %>% as.matrix() %*% abstract$imply %>% exp() %>% as.numeric()
mcmc_pred <- check_time_test %>% choose(check_time, standing) %>%
  add_column(.pred = mcmc_pred)

ggplot(mcmc_pred, aes(x = check_time, y = .pred, colour = issue(standing))) +
  geom_point() + 
  coord_cartesian(ylim = c(0, 1400)) 

Determine 4: Take a look at set predictions from the mcmc mannequin. No outliers, simply utilizing similar scale as above for comparability.

This appears good!

Wrapup

We’ve proven how you can mannequin censored information – or relatively, a frequent subtype thereof involving durations – utilizing tfprobability. The check_times information from parsnip have been a enjoyable selection, however this modeling method could also be much more helpful when censoring is extra substantial. Hopefully his put up has supplied some steering on how you can deal with censored information in your individual work. Thanks for studying!