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Understanding the role of water in protein-ligand complexes and when to consider...

Jan 25th 2022
The role of water in drug discovery should never be ignored. Its importance in ligand binding is well accepted and has an essential role in protein-drug interactions. Its role has been well ...
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The search for a better charge model

Aug 4th 2021
We present one of the most promising approaches to predicting protein-ligand interactions, compare it to Cresset’s existing methodology, and discuss what this means for future Cresset soft...
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Accessing Emerging Technologies at Alderley Park

Apr 1st 2021
Dr Raquel Faba Rodríguez, Protein Purification Specialist at Peak Proteins with be joining Cytiva and Alderley Park at this online event.
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Behind the scenes of Flare’s alchemical Free Energy Calculations

Sep 26th 2019
The main concepts and the underlying software of Flare’s FEP (Free Energy Perturbation) implementation.
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The importance of understanding protein-protein and protein-ligand interactions ...

Jul 22nd 2019
Immuno-oncology represents a new paradigm in the fight against cancer and is showing significant promise in the clinic. The first two targets of checkpoint blockade showed that T-cell activa...
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