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Application

Discovery Studio 1.0 Materials Studio 0.6111479761114798 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05020703933747412 Amorphous Cell 0.12784679089026915 Blends 0.002587991718426501 CASTEP 0.34834368530020704 CDOCKER 0.2127329192546584 CHARMm 0.2520703933747412 COMPASS 0.2696687370600414 COMPASS III 0.002587991718426501 COSMOconf 5.175983436853002E-4 COSMOperm 0.0015527950310559005 COSMOquick 0.0015527950310559005 COSMOtherm 0.04296066252587992 Catalyst 0.07349896480331262 Classical Simulations 0.7127329192546584 Conformers 0.0 Crystallization 0.05641821946169772 DFTB Plus 0.002587991718426501 DMol3 0.15838509316770186 DPD 0.006211180124223602 Discover 0.008799171842650104 Forcite 0.2686335403726708 GULP 0.028467908902691512 LUDI 0.009316770186335404 LibDock 0.07194616977225674 LigandFit 0.017080745341614908 MCSS 0.004658385093167702 MODELER 0.281055900621118 MesoDyn 0.0036231884057971015 Mesocite 0.005693581780538302 Mesoscale 0.011904761904761904 Morphology 0.017080745341614908 ONETEP 0.002070393374741201 Polymorph 0.0010351966873706005 QMERA 0.0 QSAR 5.175983436853002E-4 Quantum Mechanics 0.4943064182194617 Reflex 0.037267080745341616 Reflex Plus 0.002070393374741201 Semi-empirical 0.008799171842650104 Sorption 0.026397515527950312 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.005175983436853002 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03467908902691511

Year

2021 0.0

Keywords

target 1.0 visualization 0.2892201834862385 docking 0.25022935779816513 potential 0.19908256880733946 analysis 0.14770642201834863 between 0.1415137614678899 novel 0.09724770642201835 binding 0.09036697247706423 activity 0.0779816513761468 interaction 0.05252293577981652 protein 0.05114678899082569 well 0.03738532110091743 experimental 0.03004587155963303 synthesized 0.026376146788990827 drug 0.0231651376146789 energy 0.020642201834862386 synthesis 0.018807339449541285 compound 0.01743119266055046 cell 0.013073394495412845 mechanism 0.011467889908256881 inhibition 0.00871559633027523 chemical 0.005963302752293578 vitro 0.00481651376146789 silico 0.002981651376146789 development 0.0
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