Curve Fitting (Exp & Log) in Python

2024-09-19

Exponential Curve Fitting:

  1. Import necessary libraries:

    import numpy as np
    from scipy.optimize import curve_fit
    
  2. Define the exponential function:

    def exponential_func(x, a, b, c):
        return a * np.exp(b * x) + c
    
    • a, b, and c are the parameters to be fitted.
  3. Prepare data:

  4. Perform curve fitting:

    popt, pcov = curve_fit(exponential_func, x, y)
    
    • popt contains the optimized parameter values.
    • pcov is the covariance matrix of the parameters.
  5. Plot the fitted curve:

    import matplotlib.pyplot as plt
    
    plt.plot(x, y, 'o', label='Data')
    plt.plot(x, exponential_func(x, *popt), '-', label='Fitted curve')
    plt.xlabel('x')
    plt.ylabel('y')
    plt.legend()
    plt.show()
    

Logarithmic Curve Fitting:

Additional Considerations:

  • Evaluate the goodness of fit using metrics like R-squared or mean squared error.
  • Consider using other optimization algorithms if necessary.
  • Experiment with different initial parameter guesses to improve convergence.
  • Ensure that your data points are suitable for exponential or logarithmic fitting.



Understanding Exponential and Logarithmic Curve Fitting in Python

Key Libraries: NumPy and SciPy

  • SciPy: Offers scientific and technical computing tools, including optimization routines for curve fitting.
  • NumPy: Provides fundamental numerical operations and array manipulation.

General Approach

  1. Define the function: Specify the mathematical equation representing the curve (exponential or logarithmic).
  2. Prepare data: Create NumPy arrays for the independent (x) and dependent (y) variables.
  3. Perform curve fitting: Use scipy.optimize.curve_fit to find the optimal parameters that minimize the residual error between the fitted curve and the data.
  4. Plot the results: Visualize the data points and the fitted curve to assess the quality of the fit.
import numpy as np
from scipy.optimize import curve_fit
import matplotlib.pyplot as plt

# Define the exponential function   
def exponential_func(x, a, b):
    return a * np.exp(b * x)

# Generate sample data
x = np.linspace(0, 10, 100)
y = exponential_func(x, 2, -0.5) + np.random.normal(0, 0.2, 100)

# Perform curve fitting
popt, pcov = curve_fit(exponential_func, x, y)

# Plot the data and fitted curve
plt.plot(x, y, 'o', label='Data')
plt.plot(x, exponential_func(x, *popt), '-', label='Fitted curve')
plt.xlabel('x')
plt.ylabel('y')
plt.legend()
plt.show()
import numpy as np
from scipy.optimize import curve_fit
import matplotlib.pyplot as plt

# Define the logarithmic function
def logarithmic_func(x, a, b):
    return a * np.log(x) + b

# Generate sample data
x = np.linspace(1, 100, 100)
y = logarithmic_func(x, 3, 2) + np.random.normal(0, 0.2, 100)

# Perform curve fitting
popt, pcov = curve_fit(logarithmic_func, x, y)

# Plot the data and fitted curve
plt.plot(x, y, 'o', label='Data')
plt.plot(x, logarithmic_func(x, *popt), '-', label='Fitted curve')
plt.xlabel('x')
plt.ylabel('y')
plt.legend()
plt.show()

Key points to remember:

  • Data quality: Ensure that your data is clean and free from outliers.
  • Error analysis: Evaluate the goodness of fit to assess the model's accuracy.
  • Parameter initialization: Provide initial guesses for the parameters to help the optimization algorithm converge.
  • Function selection: Choose the appropriate function (exponential or logarithmic) based on the expected relationship between the variables.



Direct Linearization:

  • Convert the coefficients: Transform the coefficients of the linear model back to the original parameters.
  • Fit a linear model: Use linear regression techniques (e.g., numpy.polyfit) to fit a linear model to the transformed data.
  • Transform the data: For exponential functions, take the natural logarithm of both sides. For logarithmic functions, take the exponential of both sides.

Non-linear Least Squares:

  • Leverage specialized libraries: Explore libraries like lmfit or optimize.minimize for more flexibility and control over the optimization process.
  • Implement your own algorithm: Use optimization algorithms like gradient descent, Levenberg-Marquardt, or trust-region methods to minimize the sum of squared residuals.

Bayesian Inference:

  • Utilize libraries: Libraries like pymc3 or emcee can be used to implement Bayesian curve fitting.
  • Model the parameters as probability distributions: Use Bayesian methods to estimate the posterior distribution of the parameters given the data.

Machine Learning Techniques:

  • Gaussian process regression: Employ Gaussian processes to model the function and its uncertainty.
  • Support vector machines (SVMs): Use SVMs for regression tasks.
  • Neural networks: Train a neural network to approximate the desired function.

Choosing the Best Method: The optimal method depends on factors such as:

  • Desired level of control: The degree of customization and flexibility you require.
  • Computational resources: The available computational power.
  • Function complexity: The complexity of the exponential or logarithmic function.
  • Data characteristics: The nature and quality of your data.

Example: Using lmfit for Exponential Curve Fitting:

import lmfit

def exponential_func(params, x, y):
    a = params['a'].value
    b = params['b'].value
    model = a * np.exp(b * x)
    return model - y

params = lmfit.Parameters()
params.add('a', value=1.0, vary=True)
params.add('b', value=-0.5, vary=True)

result = lmfit.minimize(exponential_func, params, args=(x, y))

# Extract fitted parameters and their uncertainties
fitted_a = result.params['a'].value
fitted_b = result.params['b'].value

python numpy scipy



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