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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 Quinolones - Ozenoxacin -1 Quinolones - Ozenoxacin -1 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-1202.37328132; Eh
	2-Jul-2026	/AB-DB Macrolides - Tulathromycin +3 Macrolides - Tulathromycin +3 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-2677.8595381; Eh
	2-Jul-2026	/AB-DB Rifamycins - Rifamycin 0 Rifamycins - Rifamycin 0 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-2395.72973468; Eh
	2-Jul-2026	/AB-DB Macrolides - Oleandomycin +1 Macrolides - Oleandomycin +1 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-2328.2723709; Eh
	2-Jul-2026	/AB-DB Quinolones - Ozenoxacin -1 Quinolones - Ozenoxacin -1 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-1202.257498; Eh
	2-Jul-2026	/AB-DB Rifamycins - Rifamycin 0 Rifamycins - Rifamycin 0 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-2395.6957072; Eh
	2-Jul-2026	/AB-DB Efflux pumps inhibitors - MBX2319 0 Efflux pumps inhibitors - MBX2319 0 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	#B3LYP	6-31G(D,P)	-1605.63031590; Eh
	2-Jul-2026	/AB-DB DHFR inhibitors - Brodimoprim 0 DHFR inhibitors - Brodimoprim 0 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-3445.61421161; Eh
	2-Jul-2026	/AB-DB Efflux pumps inhibitors - MBX2319 0 Efflux pumps inhibitors - MBX2319 0 elec-pot	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	#B3LYP	6-31G(D,P)	-1605.6147824; Eh
	2-Jul-2026	/AB-DB Cephalosporins - Cephalotin -1 Cephalosporins - Cephalotin -1 opt-freq	Hospital Gasch, Adam; Malloci, Giuliano; Gervasoni, Silvia	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	B3LYP	6-31G(D,P)	-1976.13057535; Eh

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