Adsorption Locator 0.0 Amorphous Cell 0.008574007220216607 CASTEP 9.025270758122744E-4 COMPASS 0.009025270758122744 COMPASS III 0.004061371841155234 COSMOSim3D 0.0 COSMObase 0.0194043321299639 COSMOconf 0.026173285198555957 COSMOmic 0.004512635379061372 COSMOperm 0.008574007220216607 COSMOplex 0.004061371841155234 COSMOquick 0.005415162454873646 COSMOtherm 1.0 Classical Simulations 0.02075812274368231 Conformers 4.512635379061372E-4 Crystallization 0.002707581227436823 DFTB Plus 4.512635379061372E-4 DMol3 0.013989169675090252 DPD 4.512635379061372E-4 Forcite 0.013086642599277979 MesoDyn 0.0 Mesocite 0.0018050541516245488 Mesoscale 0.002256317689530686 Morphology 0.0018050541516245488 Polymorph 0.0 QSAR 4.512635379061372E-4 Quantum Mechanics 0.02527075812274368 Reflex 0.0 Semi-empirical 4.512635379061372E-4 Sorption 0.0 Synthia 0.0 TURBOMOLE 0.010830324909747292 X-Cell 0.0