MetaQSAR platform:
• Automated QSAR Modeling: Streamlines the entire QSAR workflow
— from descriptor calculation to model validation — with minimal user input.
• User-Friendly Interface: Intuitive GUI designed for both beginners
and experienced users in cheminformatics and CADD.
• Flexible Modes: Choose between Auto Mode for rapid model
development and Manual Mode for advanced customization and fine-tuning.
• Regulatory Compliance: Adheres to OECD principles ensuring scientifically valid and interpretable models.
• Robust Feature Selection: Implements powerful algorithms like Genetic Algorithm, Random Forest, and Weka-based methods.
• Comprehensive Validation: Supports internal, external, and cross-validation with applicability domain assessment and
Y-randomization testing.
• Case Study Proven: Demonstrated performance equal to or better than literature models across multiple real-world datasets.

© 2025 Copyright ProtoQSAR SL. All rights reserved.