Molecular modeling software predicts the properties of molecules based on structure, chemical formula, or other parameters when you input or are retrieved from a database. Such software may predict physical properties, structure, molecular mechanics and molecular dynamics, or other properties.
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HyperChem is a sophisticated molecular modeling environment that is known for its quality, flexibility, and ease of use. Uniting 3D visualization and animation with quantum chemical calculations, molecular mechanics, and dyna ...
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This advanced molecular modeling program is the result of over 20 years of development at a major chemical company. Molecular Modeling Pro has some of the most advanced features available in any molecular modeling program, an ...
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Advanced Molecular Modeling to Examine QSAR and QSPR Relationships
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Client/Server Chemical Modeling and Database System
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The 1D database is a powerful tool for intelligent data storage and sophisticated data querying.
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HyperProtein is Hypercube, Inc.'s new product focusing on the computational science associated with protein sequences. The product includes the analysis of one-dimensional protein sequences as well as the analysis of consequ ...
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The ADF program for molecular modeling
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The BAND program applies density functional theory to the modeling of the chemical and physical properties of periodic structures. In addition to modeling three dimensional structures (solids / crystals), the BAND program mod ...
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DDDPlus™ is software that simulates the in vitro dissolution experiment. Predict dissolution vs. time profiles for your active pharmaceutical ingredients (API) and excipients under various experimental conditions. The list ...
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GastroPlus™ is the pharmaceutical industry's leading physiological modeling & simulation software for drug discovery and development activities. 19 of the top 20 pharmaceutical companies, along with all major regulatory age ...