#---------------------------------------------- LigandID MOL70 # 209 total matches found # Counter= 000042 ProteinConformation= False Bump= -34.809 ConstraintScore= 0 Comboscore= 0.644 Colorscore= -13.080 Scaledcolor= 0.222 PK= 10.500 Quality= 2.840 Pmf= -52.450 Pmf_rb= -49.450 Smog= -175.350 Smog_h= -5.010 Chemscore= -26.540 DockNrg= -39.020 Autodock= -28.810 Surflex= -183.720 MMFF94SinglePt= NaN RMSD= -1.000 MMFF94= -31.347 OptConstraintScore= 3.0 Colorscore= -6.294 Scaledcolor= 0.107 Bump= -35.422 PK= 10.500 Quality= 2.840 Pmf= -52.450 Pmf_rb= -49.450 Smog= -175.350 Smog_h= -175.350 Chemscore= -26.540 DockNrg= -39.020 Autodock= -28.810 Surflex= -183.720 MMFF94SinglePt= NaN OptRMSD= -1.000 Fingerprint= 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MMFF94SinglePt= NaN #---------------------------------------------- BestMMFF94Poise= 42 #----------------------------------------------