EntityQ901177· pop 14· linked from 165 articlesGaussianSign in to savecomputational chemistry software packageConnectionsHartree–Fock methodEntityAutoDockEntityfree softwareEntitydigital object identifierEntityprogrammerEntityNatureEntityQ180686Entityquantum chemistryEntitychemical kineticsEntitybibcodeEntitysoftware licenseEntityJohn PopleEntityCarnegie Mellon UniversityEntityproprietary softwareEntitycomputational chemistryEntitysoftware release life cycleEntitymolecular dynamics simulationEntitydensity functional theoryEntitycheminformaticsEntityvisualizationEntityCategoriesComputational chemistry software