coli lipid extract bilayer using extensive atomistic molecular dynamics simulations, revealing a monomer inserting preference for gasdermin D compared to an oligomer preassembling preference for ...

Physical Science and Engineering Division (PSE), King Abdullah University of Science and Technology (KAUST), Thuwal 23955-6900, Saudi Arabia ...

In addition to the efforts toward building upon the FP features, we also aim to develop novel molecular dynamics (MD)-derived amino acid features. We create features for amino acids based on the MD ...

Water pollution is one of the growing challenges of modern life. Many everyday items, from medications to cosmetics, leave behind residues that don't fully break down after use. These pollutants ...