#---------------------------------------------- LigandID MOL7 # 221 total matches found # Counter= 000105 ProteinConformation= False Bump= -31.471 ConstraintScore= 0 Comboscore= 0.422 Colorscore= -7.020 Scaledcolor= 0.119 PK= 7.770 Quality= 1.990 Pmf= -47.930 Pmf_rb= -32.930 Smog= -92.610 Smog_h= -3.190 Chemscore= -15.320 DockNrg= -30.650 Autodock= -21.360 Surflex= -129.388 MMFF94SinglePt= NaN RMSD= -1.000 MMFF94= -21.462 OptConstraintScore= 2.0 Colorscore= -1.670 Scaledcolor= 0.028 Bump= -27.097 PK= 7.770 Quality= 1.990 Pmf= -47.930 Pmf_rb= -32.930 Smog= -92.610 Smog_h= -92.610 Chemscore= -15.320 DockNrg= -30.650 Autodock= -21.360 Surflex= -129.388 MMFF94SinglePt= NaN OptRMSD= -1.000 Fingerprint= 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MMFF94SinglePt= NaN #---------------------------------------------- BestMMFF94Poise= 50 #----------------------------------------------