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. 2017 Nov 6;9(2):307–314. doi: 10.1039/c7sc01996c

Fig. 4. Experimental (exptl, blue) and computed ECD spectra of (10S,11S,23S)-caulamidine A at the B3LYP/6-31G** (gas, green) and B3LYP/6-311++G** (lbs, black) levels in the gas phase and at the B3LYP-SCRF(COSMO)/6-311++G**//B3LYP/6-311++G** (sol, red) level in MeOH.

Fig. 4