Adsorption Locator 0.03207769276044732 Amorphous Cell 0.05032371983519718 Blends 0.002354326074161271 CASTEP 0.4929370217775162 CDOCKER 0.37404355503237197 CHARMm 0.44496762801648027 COMPASS 0.1153619776339023 COMPASS III 0.005885815185403178 COSMObase 0.0 COSMOconf 0.0011771630370806356 COSMOperm 5.885815185403178E-4 COSMOplex 0.0 COSMOquick 8.828722778104767E-4 COSMOtherm 0.04590935844614479 Catalyst 0.4181871689228958 Classical Simulations 0.6824602707474985 Conformers 5.885815185403178E-4 Crystallization 0.0594467333725721 DFTB Plus 0.0017657445556209534 DMol3 0.11595055915244261 DPD 0.0014714537963507945 Discover 0.014420247204237787 Forcite 0.12065921130076515 GULP 0.02972336668628605 LUDI 0.020011771630370805 LibDock 0.1224249558563861 LigandFit 0.0479693937610359 MCSS 0.004120070629782225 MODELER 0.25603296056503827 Mesocite 0.0014714537963507945 Mesoscale 0.00264861683343143 Morphology 0.010300176574455562 ONETEP 2.942907592701589E-4 Polymorph 0.00824014125956445 QSAR 0.003237198351971748 Quantum Mechanics 0.6003531489111242 Reflex 0.034726309593878756 Reflex Plus 0.005591524426133019 Reflex QPA 2.942907592701589E-4 Semi-empirical 0.0044143613890523835 Sorption 0.01059446733372572 TURBOMOLE 5.885815185403178E-4 VAMP 0.002354326074161271 Visualization 1.0 X-Cell 0.012654502648616834 ZDOCK 0.007945850500294291