PMID-sentid Pub_year Sent_text comp_official_name comp_offsetprotein_name organism prot_offset 19192492-1 2009 Ab intitio molecular dynamics simulation of the electronic structure of the aqueous superoxide anion (O2(-)) has been carried out using the Car-Parrinello density functional theory at 298 and 310 K. The modeling system consists of one O2(-) solvated in 31 water molecules. Superoxides 84-100 immunoglobulin kappa variable 1D-39 Homo sapiens 102-107 19192492-1 2009 Ab intitio molecular dynamics simulation of the electronic structure of the aqueous superoxide anion (O2(-)) has been carried out using the Car-Parrinello density functional theory at 298 and 310 K. The modeling system consists of one O2(-) solvated in 31 water molecules. Superoxides 84-100 immunoglobulin kappa variable 1D-39 Homo sapiens 235-240