Download Cresset Torch 10.4.2
Cresset Torch software full crack license download, Cresset’s Torch and Spark software to support our growing medicinal chemistry service business. Torch is a molecular design and SAR analysis application in Chemistry. Computational chemistry is an essential part of our workflow and we are confident that Torch and Spark will make a significant contribution to our lead finding and optimization projects.
Computational, medicinal and synthetic chemists use our software to make better molecule design decisions. Cresset Torch is a powerful, ligand-based molecular design and ideation platform used primarily in drug discovery and medicinal chemistry. Its core purpose is to help scientists generate novel, high-quality chemical structures by starting from a known active molecule (a “lead” compound).
Key Features and Capabilities of Cresset Torch
- Purpose: To find existing compounds in a database (e.g., corporate collection, vendor libraries) that are similar to your lead.
- How it works: You input a active molecule, and Torch will search a database, ranking hits based on field similarity, not structural similarity. This often finds highly novel chemical series that a traditional search would miss.
- Purpose: To replace a core part of your molecule (a scaffold) or a specific functional group with a novel, patentable alternative while maintaining activity.
- How it works: Torch’s “Spark” engine (integrated within Torch) uses a database of pre-calculated 3D fragments. It systematically replaces a portion of your lead molecule with these fragments and scores them based on how well their fields match. This is one of its most powerful and popular features.
- Purpose: To suggest specific small changes (e.g., adding a methyl group, changing a -Cl to a -F, adding a ring) that could improve potency or properties.
- How it works: Torch can generate a large list of analogs around your lead structure and prioritize them based on predicted activity and other calculated properties.
- Purpose: To properly model the flexible 3D shape of molecules and align multiple active molecules to find their common field patterns (the “pharmacophore”).
- How it works: Torch includes robust tools for generating low-energy 3D conformations and aligning molecules based on their field points, which is essential for understanding Structure-Activity Relationships (SAR).
- Torch can calculate key physicochemical properties (e.g., cLogP, Molecular Weight, TPSA) on the fly, allowing chemists to filter ideas not just for predicted activity, but also for “drug-likeness.”
- It integrates seamlessly with other Cresset products (like Flare for structure-based design) and can export results for use in other software or corporate databases.
Who Uses Cresset Torch software?
- Medicinal Chemists: The primary users. They use it to overcome intellectual property barriers, solve toxicity or metabolic problems, and generate new ideas for their synthetic projects.
- Computational Chemists & Modelers: Use it to build QSAR models, perform large-scale virtual screens, and provide ideation support to project teams.
- Research Scientists in Agrochemistry and Fragrance Design: The field-based approach is also applicable to other industries where small molecules interact with biological targets.
Cresset Torch software details:
- Supported operating systems: Windows 10,11 x64
- File Size: 34 MB
- Crack: full crack (unlimited PCs)
- License validity: Permanent
