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Many congratulations for being selected as a finalist @Jenkescheen! #compchem #Parliament #scicomm twitter.com/Jenkescheen/st…
Find novel bioisosteres with Spark Spark is a bioisostere replacement solution that enables drug discovery research chemists to generate highly innovative ...
Cambridge, UK – 14 September 2021 – Cresset Discovery Services, provider of contract research services for early phase of drug ...
A roundup of this month's computational chemistry news from Cresset.
The Flare Python API enables computational chemists to automate common tasks in the GUI and access Flare science from the ...
Drug discovery is an increasingly complex process with significant time and costs needed to develop a new drug from hypothesis ...
Protein-ligand binding affinity is one of the most useful metrics for predicting drug activity. Techniques for estimating binding affinity are ...
Flare™ FEP: Competitively combining speed and accuracy with ease of use Free Energy Perturbation (FEP) calculations can have the reputation to be ...
Free Energy Perturbation (FEP) calculations arm the drug hunter with highly accurate binding affinity predictions for ligands. This accuracy can ...
Cambridge, UK – 21 July 2021 – Cresset, innovative provider of outstanding software for molecule discovery and design, is pleased ...
Cambridge, UK – 14 July 2021 – Cresset, innovative provider of outstanding software for molecule discovery and design, announces the ...
Flare V5 released: Innovative science and synergy between ligand and structure-based methods Flare™ V5 is now available. This release of our comprehensive ...
High-throughput virtual screening is a powerful computational technique for exploring new chemical space, discovering diverse chemotypes and generating new IP ...