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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Jul-2026/AB-DB Quinolones - Marbofloxacin -1 Quinolones - Marbofloxacin -1 opt-freqHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumB3LYP6-31G(D,P)-1278.50612546; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Quinolones - Garenoxacin 0 Quinolones - Garenoxacin 0 opt-freqHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumB3LYP6-31G(D,P)-1498.57773643; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Penicillins - Epicillin 0 Penicillins - Epicillin 0 opt-freqHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumB3LYP6-31G(D,P)-1485.69939438; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Oxazolidinones - Posizolid 0 Oxazolidinones - Posizolid 0 elec-potHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Single point Structure#B3LYP6-31G(D,P)-1703.321403; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Oxazolidinones - Eperezolid 0 Oxazolidinones - Eperezolid 0 elec-potHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Single point Structure#B3LYP6-31G(D,P)-1394.7893062; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Quinolones - Garenoxacin 0 Quinolones - Garenoxacin 0 elec-potHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Single point Structure#B3LYP6-31G(D,P)-1498.445818; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Penicillins - Epicillin 0 Penicillins - Epicillin 0 elec-potHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Single point Structure#B3LYP6-31G(D,P)-1485.6024323; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Sulphonamides - Sulfamethizole -1 Sulphonamides - Sulfamethizole -1 opt-freqHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumB3LYP6-31G(D,P)-1514.29135925; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Quinolones - Temafloxacin 0 Quinolones - Temafloxacin 0 opt-freqHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumB3LYP6-31G(D,P)-1500.54205652; Eh
thumbnail.jpeg2-Jul-2026/AB-DB Sulphonamides - Sulfamethizole -1 Sulphonamides - Sulfamethizole -1 elec-potHospital Gasch, Adam; Malloci, Giuliano; Gervasoni, SilviaGaussian; 16; ES64L-G16RevA.03Single point Structure#B3LYP6-31G(D,P)-1514.1908373; Eh
Results 403231-403240 of 403353 (Search time: 0.257 seconds).