Getting Started

Installation

You can install SENDQSARpy using pip:

pip install sendqsarpy

Quick Start

Here’s an example of how to get started:

from sendqsarpy import main_function

# Preprocess the SEND data
processed_data = main_function("path/to/send_data")

# Train a QSAR model
model = processed_data.train_model()

# Evaluate the model
results = model.evaluate()

print(results)