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Application

Discovery Studio 0.886735464384596 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060662333642835034 Amorphous Cell 0.2878365831012071 Blends 0.0018570102135561746 CASTEP 0.3218817703497369 CDOCKER 0.15598885793871867 CHARMm 0.24945837202104612 COMPASS 0.35035592695759826 COMPASS III 0.10863509749303621 COSMObase 0.005880532342927886 COSMOconf 0.0064995357474466105 COSMOmic 0.0 COSMOperm 6.190034045187249E-4 COSMOplex 3.0950170225936243E-4 COSMOquick 6.190034045187249E-4 COSMOtherm 0.067471371092541 Catalyst 0.06654286598576292 Classical Simulations 1.0 Conformers 3.0950170225936243E-4 Crystallization 0.07366140513772826 DFTB Plus 0.0030950170225936243 DMol3 0.1541318477251625 DPD 0.002166511915815537 Discover 0.005571030640668524 Forcite 0.5419374806561436 GULP 0.01640359021974621 Kinetix 0.0 LUDI 0.003714020427112349 LibDock 0.06468585577220674 LigandFit 0.0030950170225936243 MODELER 0.23862581244196843 MesoDyn 6.190034045187249E-4 Mesocite 0.0034045187248529867 Mesoscale 0.005880532342927886 Morphology 0.017022593624264934 ONETEP 9.285051067780873E-4 Polymorph 0.0024760136180748994 QMERA 3.0950170225936243E-4 QSAR 3.0950170225936243E-4 Quantum Mechanics 0.4676570721138966 Reflex 0.052924791086350974 Reflex Plus 6.190034045187249E-4 Semi-empirical 0.004333023831631074 Sorption 0.05787681832250077 Synthia 6.190034045187249E-4 TURBOMOLE 0.0 VAMP 3.0950170225936243E-4 Visualization 0.6350974930362117 X-Cell 0.0015475085112968121 ZDOCK 0.026307644692045808

Year

2024 0.09175935288169869 2025 1.0 2026 0.967896865520728 2027 0.0

Keywords

target 1.0 potential 0.3114243566628422 analysis 0.224061629241108 docking 0.2063596131781675 visualization 0.14915587608588757 between 0.14194394361580068 promising 0.09572201278478938 novel 0.0858875594164891 energy 0.08392066874282904 binding 0.07048024913948533 cell 0.06933289624651696 performance 0.04999180462219308 stability 0.047533191280118015 activity 0.039337813473201116 strong 0.028683822324209147 including 0.02753646943124078 enhanced 0.01950499918046222 effective 0.017374200950663825 strategy 0.012293066710375349 development 0.011637436485821996 mechanism 0.010653991148991968 experimental 0.009834453368300279 synthesized 0.009178823143746927 design 0.0031142435666284217 interaction 0.0
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