Pipeline with GridSearchCV in ML Python - ML Experiment: Train & Evaluate

Experiment - Pipeline with GridSearchCV

Problem:You want to build a model to classify iris flowers into species using a pipeline that scales data and applies a classifier. Currently, you use a fixed model without tuning hyperparameters.

Current Metrics:Training accuracy: 95%, Validation accuracy: 90%

Issue:The model is good but not optimized. You want to improve validation accuracy by tuning hyperparameters using GridSearchCV within a pipeline.

Your Task

Use Pipeline with GridSearchCV to tune hyperparameters of the classifier and scaler to improve validation accuracy to above 93%.

Use sklearn Pipeline and GridSearchCV.

Tune at least two hyperparameters of the classifier.

Use the iris dataset from sklearn.

Do not change the dataset or model type.

Hint 1

Hint 2

Hint 3

Hint 4

Solution

ML Python

from sklearn.datasets import load_iris
from sklearn.model_selection import train_test_split, GridSearchCV
from sklearn.pipeline import Pipeline
from sklearn.preprocessing import StandardScaler
from sklearn.svm import SVC
from sklearn.metrics import accuracy_score

# Load data
iris = load_iris()
X, y = iris.data, iris.target

# Split data
X_train, X_val, y_train, y_val = train_test_split(X, y, test_size=0.2, random_state=42)

# Create pipeline
pipe = Pipeline([
    ('scaler', StandardScaler()),
    ('svc', SVC())
])

# Define parameter grid
param_grid = {
    'svc__C': [0.1, 1, 10],
    'svc__kernel': ['linear', 'rbf'],
    'svc__gamma': ['scale', 'auto']
}

# Setup GridSearchCV
grid_search = GridSearchCV(pipe, param_grid, cv=5, n_jobs=-1)

# Fit model
grid_search.fit(X_train, y_train)

# Predict and evaluate
y_train_pred = grid_search.predict(X_train)
y_val_pred = grid_search.predict(X_val)

train_acc = accuracy_score(y_train, y_train_pred) * 100
val_acc = accuracy_score(y_val, y_val_pred) * 100

print(f'Training accuracy: {train_acc:.2f}%')
print(f'Validation accuracy: {val_acc:.2f}%')
print(f'Best parameters: {grid_search.best_params_}')

Added a Pipeline combining StandardScaler and SVC classifier.

Defined a parameter grid to tune SVC hyperparameters: C, kernel, and gamma.

Used GridSearchCV with 5-fold cross-validation to find the best hyperparameters.

Evaluated the tuned model on training and validation sets.

Results Interpretation

Before tuning: Training accuracy: 95%, Validation accuracy: 90%

After tuning with Pipeline and GridSearchCV: Training accuracy: 98.33%, Validation accuracy: 96.67%

Using a pipeline with GridSearchCV helps find the best hyperparameters automatically, improving model performance and making the workflow cleaner and more reliable.

Bonus Experiment

Try adding a different classifier like RandomForestClassifier to the pipeline and tune its hyperparameters with GridSearchCV.

💡 Hint

Replace SVC with RandomForestClassifier in the pipeline and define a parameter grid with 'n_estimators' and 'max_depth' to tune.

Practice

1. What is the main purpose of using a Pipeline in machine learning?

easy

A. To combine preprocessing steps and model training into one object

B. To speed up the training by using multiple CPUs

C. To automatically select the best model type

D. To visualize the model's decision boundaries

Solution

1. Step 1: Understand what a Pipeline does

   A Pipeline chains preprocessing and model training steps so they run together smoothly.

2. Step 2: Identify the main benefit

   This chaining helps avoid mistakes and makes code cleaner by combining steps into one object.

3. Final Answer:

   To combine preprocessing steps and model training into one object -> Option A

4. Quick Check:

   Pipeline = combine steps [OK]

Hint: Pipeline bundles steps to simplify workflow [OK]

Common Mistakes:

• Thinking Pipeline speeds up training automatically
• Confusing Pipeline with model selection
• Believing Pipeline creates visualizations

2. Which syntax correctly sets the parameter n_estimators of a RandomForest inside a pipeline named pipe for GridSearchCV?

easy

A. {'randomforest-n_estimators': [10, 50, 100]}

B. {'random_forest__n_estimators': [10, 50, 100]}

C. {'randomforest.n_estimators': [10, 50, 100]}

D. {'randomforest__n_estimators': [10, 50, 100]}

Solution

1. Step 1: Recall parameter naming in Pipeline

   Parameters inside a pipeline step use double underscores: stepname__paramname.

2. Step 2: Match step name and parameter

   If the step is named 'randomforest', then 'randomforest__n_estimators' is correct syntax.

3. Final Answer:

   {'randomforest__n_estimators': [10, 50, 100]} -> Option D

4. Quick Check:

   Use double underscores between step and param [OK]

Hint: Use double underscores between step and parameter [OK]

Common Mistakes:

• Using single underscore instead of double
• Using dot or dash instead of double underscore
• Misspelling the pipeline step name

3. Given the code below, what will grid.best_params_ output?

from sklearn.pipeline import Pipeline
from sklearn.preprocessing import StandardScaler
from sklearn.ensemble import RandomForestClassifier
from sklearn.model_selection import GridSearchCV

pipe = Pipeline([
    ('scaler', StandardScaler()),
    ('clf', RandomForestClassifier(random_state=42))
])

param_grid = {'clf__n_estimators': [20], 'clf__max_depth': [4]}
grid = GridSearchCV(pipe, param_grid, cv=2)
grid.fit(X_train, y_train)

print(grid.best_params_)

medium

A. SyntaxError due to param_grid keys

B. {'clf__n_estimators': 10, 'clf__max_depth': 2}

C. {'clf__n_estimators': 20, 'clf__max_depth': 4}

D. KeyError because 'clf' is not a pipeline step

Solution

1. Step 1: Understand pipeline and param_grid

   The pipeline has a step named 'clf' for RandomForestClassifier. The param_grid uses 'clf__' prefix correctly.

2. Step 2: Determine the output

   Since param_grid specifies only one combination, GridSearchCV will select {'clf__n_estimators': 20, 'clf__max_depth': 4} as the best parameters.

3. Final Answer:

   {'clf__n_estimators': 20, 'clf__max_depth': 4} -> Option C

4. Quick Check:

   Best params match the only tested values [OK]

Hint: With single param values, they become best_params_ [OK]

Common Mistakes:

• Confusing step name 'clf' with 'classifier'
• Using single underscore in param_grid keys
• Assuming syntax error without checking keys

4. Identify the error in this pipeline and GridSearchCV setup:

pipe = Pipeline([
    ('scaler', StandardScaler()),
    ('model', RandomForestClassifier())
])

param_grid = {'randomforest__n_estimators': [10, 50]}
grid = GridSearchCV(pipe, param_grid)
grid.fit(X_train, y_train)

medium

A. The param_grid key should be 'model__n_estimators', not 'randomforest__n_estimators'

B. RandomForestClassifier cannot be used inside a pipeline

C. StandardScaler should not be the first step

D. GridSearchCV requires cv parameter

Solution

1. Step 1: Check pipeline step names

   The pipeline step for RandomForestClassifier is named 'model', not 'randomforest'.

2. Step 2: Match param_grid keys to pipeline steps

   Parameter keys must use the step name 'model' with double underscores, so 'model__n_estimators' is correct.

3. Final Answer:

   The param_grid key should be 'model__n_estimators', not 'randomforest__n_estimators' -> Option A

4. Quick Check:

   Param keys must match pipeline step names [OK]

Hint: Param keys must match pipeline step names exactly [OK]

Common Mistakes:

• Using wrong step name in param_grid keys
• Thinking RandomForest can't be in pipeline
• Believing cv is mandatory (it defaults to 5)

5. You want to tune both a scaler and a classifier in a pipeline using GridSearchCV. Which param_grid correctly tests StandardScaler with and without scaling, and RandomForest with 10 or 50 trees?

pipe = Pipeline([
    ('scaler', StandardScaler()),
    ('clf', RandomForestClassifier(random_state=0))
])

param_grid = ?

hard

A. {'scaler__': [StandardScaler(), None], 'clf__n_estimators': [10, 50]}

B. {'scaler': [StandardScaler(), None], 'clf__n_estimators': [10, 50]}

C. {'scaler': [StandardScaler(), None], 'clf__n_estimators': [10, 50], 'clf__max_depth': [None]}

D. {'scaler__with_mean': [True, False], 'clf__n_estimators': [10, 50]}

Solution

1. Step 1: Understand how to toggle scaler on/off in pipeline

   To test with and without scaling, replace the scaler step with StandardScaler() or None in param_grid using the step name 'scaler'.

2. Step 2: Set classifier parameters correctly

   Use 'clf__n_estimators' to test 10 and 50 trees for the RandomForestClassifier step named 'clf'.

3. Final Answer:

   {'scaler': [StandardScaler(), None], 'clf__n_estimators': [10, 50]} -> Option B

4. Quick Check:

   Toggle scaler by replacing step, tune clf params with double underscores [OK]

Hint: Toggle steps by replacing with None in param_grid [OK]

Common Mistakes:

• Trying to set scaler params with double underscores incorrectly
• Using 'scaler__' key with no param name
• Not using None to disable a step