VeraChem
VeraChem offers advanced computational chemistry software designed for precision in drug discovery. It features robust tools for predicting protein-ligand binding affinities, calculating accurate partial atomic charges, and employing the Tork algorithm for conformational searches. Additionally, it automates resonance form generation and detects molecular symmetries, enhancing research efficiency.
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Top VeraChem Features
- Protein-ligand binding affinity prediction
- Host-guest binding affinity prediction
- Fast partial atomic charge calculation
- Empirical force field computation
- Automatic resonance form generation
- Conformational search algorithm
- Tork distort-minimize optimization
- Topological symmetry detection
- 3D molecular symmetry analysis
- Modular software architecture
- High-performance computational methods
- User-friendly interface design
- Comprehensive user support
- Customizable software modules
- Integration with existing workflows
- Data visualization tools
- Automated reporting features
- Batch processing capabilities
- Support for diverse molecular types
- Real-time simulation results.
