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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Jul-2026	/AB-DB Cephalosporins - Cephaloridine 0 Cephalosporins - Cephaloridine 0 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-1995.79468294; Eh
	2-Jul-2026	/AB-DB DHFR inhibitors - Iclaprim-R 0 DHFR inhibitors - Iclaprim-R 0 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-1181.9272135; Eh
	2-Jul-2026	/AB-DB DHFR inhibitors - Trimethoprim +1 DHFR inhibitors - Trimethoprim +1 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-989.4165332; Eh
	2-Jul-2026	/AB-DB Monobactams - Nacubactam -1 Monobactams - Nacubactam -1 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	#B3LYP	6-31G(D,P)	-1495.74693463; Eh
	2-Jul-2026	/AB-DB Penicillins - Ampicillin 0 Penicillins - Ampicillin 0 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	#B3LYP	6-31G(D,P)	-1484.52191199; Eh
	2-Jul-2026	/AB-DB Cephalosporins - Cephaloridine 0 Cephalosporins - Cephaloridine 0 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-1995.7327089; Eh
	2-Jul-2026	/AB-DB Monobactams - Nacubactam -1 Monobactams - Nacubactam -1 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-1495.5436868; Eh
	2-Jul-2026	/AB-DB Cephalosporins - Cephalosporin C -2 Cephalosporins - Cephalosporin C -2 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-1781.88362051; Eh
	2-Jul-2026	/AB-DB Macrolides - Tulathromycin +3 Macrolides - Tulathromycin +3 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-2678.26219050; Eh
	2-Jul-2026	/AB-DB Streptogramins - Virginiamycin 0 Streptogramins - Virginiamycin 0 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-2803.7064204; Eh

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