Revisiting the chevrel phase: {Impact|Influence|Effect} of dispersion corrections {on the|around the} properties of Mo6S8 for cathode applications

{While|Whilst|Although|Even though|When|Though} the Mo6S8 chevrel phase is {frequently|often|regularly} {used|utilized|employed|utilised|applied|made use of} as cathode material in Mg–ion batteries, theoretical {studies|research} on this material are comparatively scarce. The {particular|specific|certain|distinct|unique} structure {of the|from…

Galaxy workflows for fragment-based virtual screening: a case study {on the|around the} SARS-CoV-2 {main|primary|principal|major|key|most important} protease

We present {several|a number of|numerous|many|various|quite a few} workflows for protein-ligand docking and {free|totally free|free of charge|cost-free|absolutely free|no cost} {energy|power} calculation for use {in the|within the|inside the} workflow management {system|method|program|technique} Galaxy.…