The meaning of score method in xgboost - xgboost

I am solving a regression problem, and I've set aside a cv data set on which I evaluate my models.
I can easily evaluate my NN network as TensorFlow evaluate() method gives me the sum of all squared errors.
However, xgb provides me with a function - score() that returns me a number - 0.7
Firstly, how should I interpret this number?
Secondly, how can I make xgb return a measure of the model that I can interpret?

Firstly, how should I interpret this number?
From the official doc, this number represents the coefficient of determination. It is the proportion of variance of your dependent variable (y) explained by the independent variable (x). Thus, the closer it is to 1, the better your regression line fits the data and the better your model is.
Secondly, how can I make xgb return a measure of the model that I can interpret?
You can use the predict method from the model and then calculate any measure you want. For example, if you want the sum of squared errors as Tensorflow does :
import xgboost as xgb
model = xgb.XGBRegressor()
model.fit(x_train, y_train)
predictions = model.predict(x_test)
ssr = ((predictions - y_test)**2).sum()

Related

Binary classification of pairs with opposite labels

I have a data-set without labels, but I do have a way to get pairs of examples with opposite labels, that is given a pair x,z I know that their true labels are either 0,1 or 1,0.
So, I am building a model that accepts pairs of samples as input, and learns to classify them with opposite labels. Assuming I have an arbitrary model for predicting a single sample, y_hat = f(x), I am building a model with Keras that accepts pairs of samples (x,z) and outputs pairs of predictions, f(x), f(z). I then use a custom loss function that drives the model towards the correct direction: Given that a regular binary classifier is trained using the Binary Cross Entropy (BCE) to make the predicted and desired output "close", I use the negative BCE. Also, since BCE is not symmetric, I symmetrize it. So, the loss function I give the model.compile method is:
from tensorflow import keras
bce = keras.losses.BinaryCrossentropy()
def neg_sym_bce(y1, y2):
return (- 0.5 * (bce(y1, y2) + bce(y2, y1)))
My problem is, this model fails to learn to classify even a single pair of my data (I get f(x)~=f(z)~=0.5), and if I try to train it with synthetic "easy" data, it takes hundreds of epochs to converge (also on a single pair).
This made me suspect that it has to do with a "vanishing gradient" problem. Indeed, when I plot (see below) the loss for a single pair, which is a function of 2 variables (the 2 outputs), it is evident that there is a wide plateau around the 0.5, 0.5 point. It is also evident that the global minima is, as expected, around the points 0,1 and 1,0.
So, is there a way to deal with the vanishing gradient here? I read about the problem but the references I found deal with vanishing gradient in the network, not in the loss itself.
Or, is there another loss that can drive the model to predict opposite labels?
Think if your labels are always either 0,1 or 1,1 just use categorical_crossentropy for the loss.

Keras: Custom loss function with training data not directly related to model

I am trying to convert my CNN written with tensorflow layers to use the keras api in tensorflow (I am using the keras api provided by TF 1.x), and am having issue writing a custom loss function, to train the model.
According to this guide, when defining a loss function it expects the arguments (y_true, y_pred)
https://www.tensorflow.org/guide/keras/train_and_evaluate#custom_losses
def basic_loss_function(y_true, y_pred):
return ...
However, in every example I have seen, y_true is somehow directly related to the model (in the simple case it is the output of the network). In my problem, this is not the case. How do implement this if my loss function depends on some training data that is unrelated to the tensors of the model?
To be concrete, here is my problem:
I am trying to learn an image embedding trained on pairs of images. My training data includes image pairs and annotations of matching points between the image pairs (image coordinates). The input feature is only the image pairs, and the network is trained in a siamese configuration.
I am able to implement this successfully with tensorflow layers and train it sucesfully with tensorflow estimators.
My current implementations builds a tf Dataset from a large database of tf Records, where the features is a dictionary containing the images and arrays of matching points. Before I could easily feed these arrays of image coordinates to the loss function, but here it is unclear how to do so.
There is a hack I often use that is to calculate the loss within the model, by means of Lambda layers. (When the loss is independent from the true data, for instance, and the model doesn't really have an output to be compared)
In a functional API model:
def loss_calc(x):
loss_input_1, loss_input_2 = x #arbirtray inputs, you choose
#according to what you gave to the Lambda layer
#here you use some external data that doesn't relate to the samples
externalData = K.constant(external_numpy_data)
#calculate the loss
return the loss
Using the outputs of the model itself (the tensor(s) that are used in your loss)
loss = Lambda(loss_calc)([model_output_1, model_output_2])
Create the model outputting the loss instead of the outputs:
model = Model(inputs, loss)
Create a dummy keras loss function for compilation:
def dummy_loss(y_true, y_pred):
return y_pred #where y_pred is the loss itself, the output of the model above
model.compile(loss = dummy_loss, ....)
Use any dummy array correctly sized regarding number of samples for training, it will be ignored:
model.fit(your_inputs, np.zeros((number_of_samples,)), ...)
Another way of doing it, is using a custom training loop.
This is much more work, though.
Although you're using TF1, you can still turn eager execution on at the very beginning of your code and do stuff like it's done in TF2. (tf.enable_eager_execution())
Follow the tutorial for custom training loops: https://www.tensorflow.org/tutorials/customization/custom_training_walkthrough
Here, you calculate the gradients yourself, of any result regarding whatever you want. This means you don't need to follow Keras standards of training.
Finally, you can use the approach you suggested of model.add_loss.
In this case, you calculate the loss exaclty the same way I did in the first answer. And pass this loss tensor to add_loss.
You can probably compile a model with loss=None then (not sure), because you're going to use other losses, not the standard one.
In this case, your model's output will probably be None too, and you should fit with y=None.

Is it possible to integrate Levenberg-Marquardt optimizer from Tensorflow Graphics with a Tensorflow 2.0 model?

I have a Tensorflow 2.0 tf.keras.Sequential model. Now, my technical specification prescribes using the Levenberg-Marquardt optimizer to fit the model. Tensorflow 2.0 doesn't provide it as an optimizer out of the box, but it is available in the Tensorflow Graphics module.
tfg.math.optimizer.levenberg_marquardt.minimize function accepts residuals ( a residual is a Python callable returning a tensor) and variables (list of tensors corresponding to my model weights) as parameters.
What would be the best way to convert my model into residuals and variables?
If I understand correctly how the minimize function works, I have to provide two residuals. The first residual must call my model for every learning case and aggregate all the results into a tensor. The second residuals must return all labels as a single constant tensor. The problem is that tf.keras.Sequential.predict function returns a numpy array instead of tensor. I believe that if I convert it to a tensor, the minimizer won't be able to calculate jacobians with respect to variables.
The same problem is with variables. It doesn't seem like there's a way to extract all weights from a model into a list of tensors.
There's a major difference between tfg.math.optimizer.levenberg_marquardt.minimize and Keras optimizers from the implementation/API perspective.
Keras optimizers, such as tf.keras.optimizers.Adam consume gradients as input and updates tf.Variables.
In contrast, tfg.math.optimizer.levenberg_marquardt.minimize essentially unrolls the optimization loop in graph mode (using a tf.while_loop construct). It takes initial parameter values and produces updated parameter values, unlike Adam & co, which only apply one iteration and actually change the values of tf.Variables via assign_add.
Stepping back a bit to the theoretical big picture, Levenberg-Marquardt is not a general gradient descent-like solver for any nonlinear optimization problem (such as Adam is). It specifically addresses nonlinear least-squares optimization, so it's not a drop-in replacement for optimizers like Adam. In gradient descent, we compute the gradient of the loss with respect to the parameters. In Levenberg-Marquardt, we compute the Jacobian of the residuals with respect to the parameters. Concretely, it repeatedly solves the linearized problem Jacobian # delta_params = residuals for delta_params using tf.linalg.lstsq (which internally uses Cholesky decomposition on the Gram matrix computed from the Jacobian) and applies delta_params as the update.
Note that this lstsq operation has cubic complexity in the number of parameters, so in case of neural nets it can only be applied for fairly small ones.
Also note that Levenberg-Marquardt is usually applied as a batch algorithm, not a minibatch algorithm like SGD, though there's nothing stopping you from applying the LM iteration on different minibatches in each iteration.
I think you may only be able to get one iteration out of tfg's LM algorithm, through something like
from tensorflow_graphics.math.optimizer.levenberg_marquardt import minimize as lm_minimize
for input_batch, target_batch in dataset:
def residual_fn(trainable_params):
# do not use trainable params, it will still be at its initial value, since we only do one iteration of Levenberg Marquardt each time.
return model(input_batch) - target_batch
new_objective_value, new_params = lm_minimize(residual_fn, model.trainable_variables, max_iter=1)
for var, new_param in zip(model.trainable_variables, new_params):
var.assign(new_param)
In contrast, I believe the following naive method will not work where we assign model parameters before computing the residuals:
from tensorflow_graphics.math.optimizer.levenberg_marquardt import minimize as lm_minimize
dataset_iterator = ...
def residual_fn(params):
input_batch, target_batch = next(dataset_iterator)
for var, param in zip(model.trainable_variables, params):
var.assign(param)
return model(input_batch) - target_batch
final_objective, final_params = lm_minimize(residual_fn, model.trainable_variables, max_iter=10000)
for var, final_param in zip(model.trainable_variables, final_params):
var.assign(final_param)
The main conceptual problem is that residual_fn's output has no gradients wrt its input params, since this dependency goes through a tf.assign. But it might even fail before that due to using constructs that are disallowed in graph mode.
Overall I believe it's best to write your own LM optimizer that works on tf.Variables, since tfg.math.optimizer.levenberg_marquardt.minimize has a very different API that is not really suited for optimizing Keras model parameters since you can't directly compute model(input, parameters) - target_value without a tf.assign.

Get values of tensors in loss function

I would like to get the values of the y_pred and y_true tensors of this keras backend function. I need this to be able to perform some custom calculations and change the loss, these calculations are just possible with the real array values.
def mean_squared_error(y_true, y_pred):
#some code here
return K.mean(K.square(y_pred - y_true), axis=-1)
There is a way to do this in keras? Or in any other ML framework (tf, pytorch, theano)?
No, in general you can't compute the loss that way, because Keras is based on frameworks that do automatic differentiation (like Theano, TensorFlow) and they need to know which operations you are doing in between in order to compute the gradients of the loss.
You need to implement your loss computations using keras.backend functions, else there is no way to compute gradients and optimization won't be possible.
Try including this within the loss function:
y_true = keras.backend.print_tensor(y_true, message='y_true')
Following is an excerpt from the Keras documentation (https://keras.io/backend/):
print_tensor
keras.backend.print_tensor(x, message='')
Prints message and the tensor value when evaluated.
Note that print_tensor returns a new tensor identical to x which should be used in the later parts of the code. Otherwise, the print operation is not taken into account during evaluation.

DeepLearning Anomaly Detection for images

I am still relatively new to the world of Deep Learning. I wanted to create a Deep Learning model (preferably using Tensorflow/Keras) for image anomaly detection. By anomaly detection I mean, essentially a OneClassSVM.
I have already tried sklearn's OneClassSVM using HOG features from the image. I was wondering if there is some example of how I can do this in deep learning. I looked up but couldn't find one single code piece that handles this case.
The way of doing this in Keras is with the KerasRegressor wrapper module (they wrap sci-kit learn's regressor interface). Useful information can also be found in the source code of that module. Basically you first have to define your Network Model, for example:
def simple_model():
#Input layer
data_in = Input(shape=(13,))
#First layer, fully connected, ReLU activation
layer_1 = Dense(13,activation='relu',kernel_initializer='normal')(data_in)
#second layer...etc
layer_2 = Dense(6,activation='relu',kernel_initializer='normal')(layer_1)
#Output, single node without activation
data_out = Dense(1, kernel_initializer='normal')(layer_2)
#Save and Compile model
model = Model(inputs=data_in, outputs=data_out)
#you may choose any loss or optimizer function, be careful which you chose
model.compile(loss='mean_squared_error', optimizer='adam')
return model
Then, pass it to the KerasRegressor builder and fit with your data:
from keras.wrappers.scikit_learn import KerasRegressor
#chose your epochs and batches
regressor = KerasRegressor(build_fn=simple_model, nb_epoch=100, batch_size=64)
#fit with your data
regressor.fit(data, labels, epochs=100)
For which you can now do predictions or obtain its score:
p = regressor.predict(data_test) #obtain predicted value
score = regressor.score(data_test, labels_test) #obtain test score
In your case, as you need to detect anomalous images from the ones that are ok, one approach you can take is to train your regressor by passing anomalous images labeled 1 and images that are ok labeled 0.
This will make your model to return a value closer to 1 when the input is an anomalous image, enabling you to threshold the desired results. You can think of this output as its R^2 coefficient to the "Anomalous Model" you trained as 1 (perfect match).
Also, as you mentioned, Autoencoders are another way to do anomaly detection. For this I suggest you take a look at the Keras Blog post Building Autoencoders in Keras, where they explain in detail about the implementation of them with the Keras library.
It is worth noticing that Single-class classification is another way of saying Regression.
Classification tries to find a probability distribution among the N possible classes, and you usually pick the most probable class as the output (that is why most Classification Networks use Sigmoid activation on their output labels, as it has range [0, 1]). Its output is discrete/categorical.
Similarly, Regression tries to find the best model that represents your data, by minimizing the error or some other metric (like the well-known R^2 metric, or Coefficient of Determination). Its output is a real number/continuous (and the reason why most Regression Networks don't use activations on their outputs). I hope this helps, good luck with your coding.