The pH-dependent Swelling of Weak Polyelectrolyte Hydrogels Modeled at {Different|Various|Distinct|Diverse|Unique|Distinctive} Levels of Resolution

The swelling of polyelectrolyte hydrogels has been {often|frequently|usually|typically|generally|normally} explained {using|utilizing|making use of|employing|working with|applying} {simple|easy|straightforward|basic|uncomplicated|very simple} models derived {from the|in the} Flory-Rehner model.{While|Whilst|Although|Even though|When|Though} these models qualitatively predict the experimentally observed…

A {Generally|Usually|Typically|Normally|Commonly|Frequently} Applicable Atomic-Charge Dependent London Dispersion Correction Scheme

The D4 model is presented for the {accurate|correct|precise} computation of London dispersion interactions in density functional theory approximations (DFT-D4) and {generally|usually|typically|normally|commonly|frequently} for atomistic modeling {methods|techniques|strategies|approaches|procedures|solutions}. {In this|Within this} successor {to…

GenUI: Interactive and Extensible Open {Source|Supply} {Software|Software program|Computer software|Application} Platform for De Novo Molecular Generation

This manuscript describes the {development|improvement} and architecture {of the|from the|in the|on the|with the|of your} GenUI {software|software program|computer software|application} platform for integration of molecular generators. The {source|supply} code for the {components|elements}…