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Compound generation
Chemical space is vast. Give yourself the best chance of success, using a range of methods to rigorously explore many ideas and optimisation strategies.
Compound optimisation
From your initial compounds you want to improve physicochemical and ADME properties, whilst also ensuring good target activity and selectivity.
3D molecular design and visualisation
Understand structure-activity and structure-property relationships in 3D, with cutting-edge computational modelling.
AI data analysis
Reveal transformative insights with AI-guided discovery
Data analysis and SAR
In discovery, whether your starting point is a compound structure, target or data on literature or proprietary compounds, the first step is to make sense of the information you already have.
3D macrocycle modelling
Industry-leading 3D macrocycle modelling. Orders of magnitude faster and more accurate than any competing solution, proven to reduce synthesis requirements by up to 90%.
Collaboration
Integrate powerful real-time collaboration into every stage of your molecule design and optimisation workflow.
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A complete platform for molecular design, optimisation and data analysis
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Transformative insights, revealed, with AI-guided discovery
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Harness cutting edge models for 3D ligand-based and structure-based design
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Accurate metabolism insights, tailored for DMPK scientists
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Your questions, answered. Our experts chat science, software set-up, and more
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Discover success stories from our customers and collaborators.
StarDrop
Cerella
Ebooks
Want in-depth expertise on the key topics shaping our industry? Browse our latest ebooks.
Webinars
Join the conversation. Tune into expert-led sessions exploring drug discovery.
Posters
Can’t make it to a conference? You can browse our posters here instead
Publications
From 3D design to generative chemistry, catch up with the latest developments from our R&D teams.
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Videos
Watch our tutorials and tips videos to understand how best to use all the features of our software
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Integrations, models and collections
Connect to key third-party applications, download pre-built models and scoring profiles, and access vast virtual libraries
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Get all the answers to your specific software and scientific questions through our dedicated Support page.
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Find your installation files, user and reference guides for smooth software sailing.
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About Optibrium
We are Optibrium
Find out more about Optibrium’s history, team and collaborators, and learn how we’re transforming discovery
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Are you interested in joining the team? See what life is like at Optibrium and browse our jobs
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