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Application

Discovery Studio 1.0 Materials Studio 0.2996040475142983 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.016563146997929608 Amorphous Cell 0.07177363699102829 Blends 0.0 CASTEP 0.1663216011042098 CDOCKER 0.20013802622498275 CHARMm 0.23947550034506557 COMPASS 0.1276742581090407 COMPASS III 0.002070393374741201 COSMOconf 0.0 COSMOperm 6.901311249137336E-4 COSMOquick 6.901311249137336E-4 COSMOtherm 0.024844720496894408 Catalyst 0.07315389924085576 Classical Simulations 0.46307798481711526 Conformers 0.0 Crystallization 0.033126293995859216 DFTB Plus 0.0 DMol3 0.0738440303657695 DPD 0.002070393374741201 Discover 0.003450655624568668 Forcite 0.13388543823326432 GULP 0.011042097998619738 LUDI 0.005521048999309869 LibDock 0.06625258799171843 LigandFit 0.01518288474810214 MCSS 0.0027605244996549345 MODELER 0.26224982746721875 MesoDyn 6.901311249137336E-4 Mesocite 0.002070393374741201 Mesoscale 0.004140786749482402 Morphology 0.010351966873706004 ONETEP 6.901311249137336E-4 Quantum Mechanics 0.23464458247066944 Reflex 0.022774327122153208 Reflex Plus 6.901311249137336E-4 Semi-empirical 0.002070393374741201 Sorption 0.013112491373360938 VAMP 0.0013802622498274672 Visualization 1.0 X-Cell 0.0 ZDOCK 0.031055900621118012

Year

2021 0.0

Keywords

target 1.0 visualization 0.3966973886328725 docking 0.3460061443932412 potential 0.23809523809523808 analysis 0.1685867895545315 binding 0.13671274961597543 novel 0.1228878648233487 between 0.11943164362519201 activity 0.11405529953917051 protein 0.08794162826420891 interaction 0.060675883256528416 drug 0.050307219662058374 synthesis 0.04185867895545315 vitro 0.03840245775729647 compound 0.03763440860215054 silico 0.03609831029185868 treatment 0.03456221198156682 synthesized 0.03379416282642089 inhibition 0.030337941628264208 well 0.02227342549923195 development 0.01804915514592934 cell 0.012672811059907835 mechanism 0.009600614439324117 active 0.007680491551459293 promising 0.0
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