Fig. 8
The selected B3LYP/aug-pcJ-0 calculated spin–spin constants J (in Hz) for both “exp-opt” conformers of clindamycin, i.e., A (top) and B (bottom), optimized at the B3LYP/6-31G** level in vacuum
Fig. 8 | Journal of Molecular Modeling
The selected B3LYP/aug-pcJ-0 calculated spin–spin constants J (in Hz) for both “exp-opt” conformers of clindamycin, i.e., A (top) and B (bottom), optimized at the B3LYP/6-31G** level in vacuum