#---------------------------------------------- LigandID MOL108 # 1 total matches found # Counter= 000001 ProteinConformation= False Bump= -6.019 ConstraintScore= 0 Comboscore= 0.319 Colorscore= -6.341 Scaledcolor= 0.107 PK= 7.530 Quality= 1.750 Pmf= -46.700 Pmf_rb= -46.700 Smog= -145.240 Smog_h= -9.080 Chemscore= -23.730 DockNrg= -25.430 Autodock= -18.020 Surflex= -64.974 MMFF94SinglePt= NaN RMSD= -1.000 MMFF94= -14.786 OptConstraintScore= 3.0 Colorscore= -3.784 Scaledcolor= 0.064 Bump= -25.546 PK= 7.530 Quality= 1.750 Pmf= -46.700 Pmf_rb= -46.700 Smog= -145.240 Smog_h= -145.240 Chemscore= -23.730 DockNrg= -25.430 Autodock= -18.020 Surflex= -64.974 MMFF94SinglePt= NaN OptRMSD= -1.000 Fingerprint= 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MMFF94SinglePt= NaN #---------------------------------------------- BestMMFF94Poise= 1 #----------------------------------------------