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Flare™
Agile ligand-based and structure-based drug design solution
Spark™
Scaffold hopping and R-group replacement to generate innovative ideas for your discovery projects
Server
Blaze™
Ligand-based virtual screening to dramatically increase your screening hit rate at a fraction of the cost
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Torx®
Make better design decisions and track compound synthesis from start to finish with ease
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Robust science for results you can rely on
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Discovery CRO
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Discovery overview
Make the molecules that matter
Why Cresset Discovery?
As your computational chemistry CRO, we bring a unique perspective to help you advance your discovery project performance
Discovery capabilities
Examples of the consultancy provided to advance your project
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Bridge resource gaps
Broaden and protect your IP position
Find a chemical starting point
Reposition existing drugs
Manage your procurement process
Develop bespoke software
Innovative 3D clustering method created to deliver diverse fragment libraries
Define the bioactive conformation
Run virtual screens
Modeling structures of novel biological targets
Conduct ligand-protein docking
Deducing ligand-protein interactions
Identify new chemical series
Grow and link fragments
Analyze SAR and property data
Streamline optimization
Create and analyze 3D-QSAR
Novel patentable chemistry
Move from hit to lead
Reduce risk and increase value in your life science investments
Identify and avoid problematic active sites
Helping to understand protein conformations with molecular dynamics
Identifying allosteric pockets
The business case for specialist modelers running your FEP calculations
Protein preparation
Orotomides, a new class of DHODH targeting anti-fungal drugs
Novel seed treatment discovered and patented
Discovering a Novel Therapy for Urinary Tract Infections Through Outsourcing In-silico Drug Discovery
Identifying promising inhibitors against epilepsy using virtual screening
Grant applications
Cresset Discovery case studies
Case studies we have permission to publish
Discovery webinar recordings
Request webinars to watch
Free confidential discussion
Request a free no-risk confidential discussion with our CADD experts
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Computational chemists
Results you can rely on
Medicinal chemists
Make better design decisions
Biologists
We help you remove obstacles
Academics
Solutions for teaching and research
About
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About Cresset
Your scientific partner for molecule design
Testimonials
See what our customers say about our software and services
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Home
Software
Back
Software
desktop
Flare™
Spark™
Server
Blaze™
Cloud
Torx®
Science
Back
Science
Science overview
Citations
Resources
Scientific Advisory Board
Support
Back
Support
Support resources
Product releases
Installation
Tips and tricks
Citing Cresset applications
Software webinar recordings
Discovery CRO
Back
Discovery CRO
Discovery overview
Why Cresset Discovery?
Discovery capabilities
Back
Discovery capabilities
Bridge resource gaps
Broaden and protect your IP position
Find a chemical starting point
Reposition existing drugs
Manage your procurement process
Develop bespoke software
Innovative 3D clustering method created to deliver diverse fragment libraries
Define the bioactive conformation
Run virtual screens
Modeling structures of novel biological targets
Conduct ligand-protein docking
Deducing ligand-protein interactions
Identify new chemical series
Grow and link fragments
Analyze SAR and property data
Streamline optimization
Create and analyze 3D-QSAR
Novel patentable chemistry
Move from hit to lead
Reduce risk and increase value in your life science investments
Identify and avoid problematic active sites
Helping to understand protein conformations with molecular dynamics
Identifying allosteric pockets
The business case for specialist modelers running your FEP calculations
Protein preparation
Orotomides, a new class of DHODH targeting anti-fungal drugs
Novel seed treatment discovered and patented
Discovering a Novel Therapy for Urinary Tract Infections Through Outsourcing In-silico Drug Discovery
Identifying promising inhibitors against epilepsy using virtual screening
Grant applications
Cresset Discovery case studies
Discovery webinar recordings
Free confidential discussion
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