Machine Learning With Pytorch and Scikit-Learn
Machine Learning (ML) is at the core of modern intelligent applications. Whether you’re building recommendation systems, chatbots, or fraud detection algorithms, understanding ML is essential. Two of the most powerful Python libraries that enable this are scikit-learn and PyTorch.
- scikit-learn is ideal for classical machine learning (linear regression, decision trees, SVMs, etc.).
- PyTorch shines in deep learning tasks and gives more control over building and training neural networks.
Together, they offer a robust ecosystem for tackling a wide range of ML problems.
🔹 Scikit-learn Overview
What is Scikit-learn?
Scikit-learn is a high-level Python library built on NumPy, SciPy, and matplotlib. It’s designed for classical machine learning and provides simple APIs to:
- Load and preprocess data
- Train and evaluate models
- Tune hyperparameters
- Build pipelines
Key Features
- Easy-to-use and consistent API
- Supports regression, classification, clustering, and dimensionality reduction
- Integrated model evaluation and cross-validation tools
- Feature scaling, encoding, and splitting tools
🔹 PyTorch Overview
What is PyTorch?
PyTorch is a deep learning framework developed by Facebook AI. It’s favored for its dynamic computation graph (eager execution), making it flexible and pythonic.
It’s commonly used for:
- Deep neural networks
- Natural Language Processing (NLP)
- Computer Vision
- Reinforcement Learning
Key Features
- Tensor operations with GPU acceleration
- Autograd for automatic differentiation
- Modular model architecture via
torch.nn
- Deep integration with Python’s ecosystem
- Highly customizable training loop
🔸 Typical Use Cases
Task | Use scikit-learn? | Use PyTorch? |
---|---|---|
Linear Regression | ✅ Yes | 🚫 Overkill |
Image Classification | 🚫 Limited | ✅ Yes |
SVM/Random Forest | ✅ Yes | 🚫 Not built-in |
Custom Neural Network | 🚫 Not available | ✅ Yes |
Quick Prototyping | ✅ Fast | 🚫 Slower |
✅ Common Workflow in scikit-learn
Let’s say we want to predict house prices using a linear regression model:
from sklearn.datasets import load_boston
from sklearn.model_selection import train_test_split
from sklearn.linear_model import LinearRegression
from sklearn.metrics import mean_squared_error
# Load data
X, y = load_boston(return_X_y=True)
# Split data
X_train, X_test, y_train, y_test = train_test_split(X, y, test_size=0.2)
# Create model
model = LinearRegression()
model.fit(X_train, y_train)
# Predict
predictions = model.predict(X_test)
# Evaluate
print("MSE:", mean_squared_error(y_test, predictions))
You don’t need to define any custom loops—everything’s abstracted for simplicity.
✅ Common Workflow in PyTorch
Suppose you’re building a simple neural network:
import torch
import torch.nn as nn
import torch.optim as optim
from sklearn.datasets import load_boston
from sklearn.model_selection import train_test_split
from sklearn.preprocessing import StandardScaler
# Load and preprocess
X, y = load_boston(return_X_y=True)
X_train, X_test, y_train, y_test = train_test_split(X, y, test_size=0.2)
scaler = StandardScaler()
X_train = scaler.fit_transform(X_train)
X_test = scaler.transform(X_test)
# Convert to tensors
X_train = torch.tensor(X_train, dtype=torch.float32)
y_train = torch.tensor(y_train, dtype=torch.float32).view(-1, 1)
# Build model
class Net(nn.Module):
def __init__(self):
super(Net, self).__init__()
self.fc1 = nn.Linear(13, 50)
self.fc2 = nn.Linear(50, 1)
def forward(self, x):
x = torch.relu(self.fc1(x))
return self.fc2(x)
model = Net()
criterion = nn.MSELoss()
optimizer = optim.Adam(model.parameters(), lr=0.01)
# Training loop
for epoch in range(100):
outputs = model(X_train)
loss = criterion(outputs, y_train)
optimizer.zero_grad()
loss.backward()
optimizer.step()
if epoch % 10 == 0:
print(f'Epoch {epoch}, Loss: {loss.item()}')
Here, you have full control over every part of the training pipeline.
🔄 Combining Scikit-learn + PyTorch
You can integrate scikit-learn and PyTorch. Example: using sklearn.model_selection.KFold
for PyTorch cross-validation, or preprocessing with sklearn.preprocessing.StandardScaler
before sending data to a PyTorch model.
from sklearn.model_selection import KFold
kf = KFold(n_splits=5)
for train_idx, val_idx in kf.split(X):
X_train, X_val = X[train_idx], X[val_idx]
# Convert and train using PyTorch here
🔍 Feature Comparison Table
Feature | Scikit-learn | PyTorch |
---|---|---|
Learning Curve Simplicity | ✅ Very Simple | ❌ Manual |
Custom Neural Nets | ❌ Not supported | ✅ Fully Supported |
GPU Support | ❌ No | ✅ Yes |
Model Interpretability | ✅ Easier | ❌ Needs work |
Speed for Small Models | ✅ Fast | ❌ Slightly Slower |
Production Deployment | ✅ Easy with Pickle | ✅ TorchScript, ONNX |
📊 Visualization and Monitoring
For PyTorch:
- Use TensorBoard to monitor training and visualize weights.
- Libraries like TorchViz help visualize the model graph.
For Scikit-learn:
- Use matplotlib, seaborn, and
plot_learning_curve
.
🧠 Deep Learning vs Classical ML
Aspect | Classical ML (Scikit-learn) | Deep Learning (PyTorch) |
---|---|---|
Dataset Size | Small to Medium | Medium to Large |
Feature Engineering | Manual | Often automatic (via NN layers) |
Training Time | Fast | Long (can be accelerated) |
Model Complexity | Simple | Very High |
Explainability | Easier | Harder |
📦 Model Deployment
- Scikit-learn models can be saved using
joblib
orpickle
. - PyTorch models use
torch.save()
for saving andtorch.load()
for reloading.
Both can be served via APIs using Flask, FastAPI, or cloud platforms like AWS, GCP, or Azure.
📘 Learning Resources
- Books:
- Hands-On Machine Learning with Scikit-learn, Keras, and TensorFlow by Aurélien Géron
- Deep Learning with PyTorch by Eli Stevens
- Courses:
- Coursera: ML with Python
- fast.ai for PyTorch
- Udacity: Intro to Deep Learning with PyTorch
- Practice Sites:
✅ Final Thoughts
Machine Learning with scikit-learn and PyTorch gives you the best of both worlds:
- Use scikit-learn when you need fast experimentation with reliable models and simpler pipelines.
- Use PyTorch when you’re building neural networks, working with large datasets, or exploring cutting-edge AI.
Learning both allows you to be versatile and apply the right tools for the job, which is key in the rapidly evolving world of AI and ML.