Molecular Design

<< previous || next >> Enthalpy-driven binding has been presented as a rationale for screening fragments although some have ar...

Paramin panorama Crystallographic fragment screens have been run recently against the main protease (at Diamond ) and the Nsp3 macrodomain (...

I recently published The Nature of Ligand Efficiency (NoLE) as a ChemRxiv preprint and this was featured (for all the right reasons) in ...

The third annual survey (F2L2017) of fragment-to-lead (F2L) optimizations was published last week. Given that it was the second survey ...

<< previous || next >> Researchers at The Hungarian Institute Of Thermodynamics have published a number of seminal articles o...

Metrics are like  the heads of the Hydra . Dispatch one and two pop up to take its place. So #RealTimeChem week is over and it's tim...

I guess it had to happen.  Our gentle  critique  of ligand efficiency metrics (LEMs) has finally triggered a response in the form of a jou...