MD | molecular dynamics |
n.occ. | number of occurrences |
OppA | oligopeptide-binding protein A |
QSAR | quantitative structure-activity-relationship |
TI | thermodynamic integration |
MD | molecular dynamics |
n.occ. | number of occurrences |
OppA | oligopeptide-binding protein A |
QSAR | quantitative structure-activity-relationship |
TI | thermodynamic integration |