One such example is an interactive global climate map -- mobile plasma screens that glide across a timeline of the past century.
The binding affinity toward HDAC2 of the compounds was screened by Glide docking.
Through virtual screening by Glide, 170 fragments were selected from a fragment based library of 3,200 substances on the basis of their average internal rank towards the ATP-binding site of five crystal structures of four kinases of different types and one chaperone (MST3, Hsp90, JNK3, PKA, and VEGFR).
In sequences that slip into and out of synch with one another on the different screens, the camera glides around Minnie, scrutinizing her baggy, wrinkly, bristly mountainousness — her pachydermity.
Based on active site structural differences between LSS and human spermidine synthase (HSS), we screened a large dataset of compounds against modeled protein using Glide virtual screen docking and selected two best inhibitors based on their docking scores (− 10.04 and − 13.11 respectively) with LSS and having least/no binding with the human enzyme.
After the screening, the audience glided en masse to the after-party, a few blocks away at the Trilby, the bar and restaurant at the Cooper Square Hotel.
We have shown in this study that application of comparable setups for the preparation of targets, bioactives and decoys by different modeling packages (Maestro or MOE) affected the screening performance of Glide and GOLD in the majority of the investigated targets.
Here, the performance of four popular virtual screening programs, Gold, Glide, Surflex and FlexX, is compared using the Directory of Useful Decoys-Enhanced database (DUD-E), which includes 102 targets with an average of 224 ligands per target and 50 decoys per ligand, generated to avoid biases in the benchmarking.
The four side-stage video screens began to glide across the stage, and swiveled around to reveal Timberlake behind one and Madonna behind the other.
