#---------------------------------------------- LigandID MOL53 # 255 total matches found # Counter= 000231 ProteinConformation= False Bump= -39.064 ConstraintScore= 0 Comboscore= 0.459 Colorscore= -8.427 Scaledcolor= 0.143 PK= 5.960 Quality= 1.330 Pmf= -71.850 Pmf_rb= -56.850 Smog= -85.040 Smog_h= -3.040 Chemscore= -18.260 DockNrg= -22.990 Autodock= -23.840 Surflex= -192.098 MMFF94SinglePt= NaN RMSD= -1.000 MMFF94= -28.256 OptConstraintScore= 3.0 Colorscore= -1.955 Scaledcolor= 0.033 Bump= -30.549 PK= 5.960 Quality= 1.330 Pmf= -71.850 Pmf_rb= -56.850 Smog= -85.040 Smog_h= -85.040 Chemscore= -18.260 DockNrg= -22.990 Autodock= -23.840 Surflex= -192.098 MMFF94SinglePt= NaN OptRMSD= -1.000 Fingerprint= 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MMFF94SinglePt= NaN #---------------------------------------------- BestMMFF94Poise= 79 #----------------------------------------------