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Application

Discovery Studio 0.8458099712077588 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06931504044230573 Amorphous Cell 0.2873963345960889 Blends 0.0025596396027439336 CASTEP 0.40217057438312687 CDOCKER 0.14927818163202622 CHARMm 0.23415583085901506 COMPASS 0.372581140575407 COMPASS III 0.08661820415685471 COSMObase 0.003788266612061022 COSMOconf 0.004197808948500051 COSMOmic 2.047711682195147E-4 COSMOperm 0.0014333981775366028 COSMOplex 2.047711682195147E-4 COSMOquick 0.0016381693457561176 COSMOtherm 0.06562915941435446 Cantera 0.0 Catalyst 0.10074741476400123 Classical Simulations 1.0 Conformers 0.0010238558410975735 Crystallization 0.07597010340943995 DFTB Plus 0.005528821541926896 DMol3 0.18224633971536808 DPD 0.0028667963550732057 Discover 0.0038906521961707794 Forcite 0.5520630695198117 GULP 0.025596396027439336 Kinetix 3.07156752329272E-4 LUDI 0.003788266612061022 LibDock 0.06388860448448859 LigandFit 0.004607351284939081 MCSS 7.166990887683014E-4 MODELER 0.1831678099723559 MesoDyn 0.0016381693457561176 Mesocite 0.003788266612061022 Mesoscale 0.007371762055902529 Modules 0.0 Morphology 0.017507934882768507 ONETEP 0.0011262414252073308 Polymorph 0.0019453260980853897 QMERA 2.047711682195147E-4 QSAR 9.214702569878161E-4 Quantum Mechanics 0.5721306440053241 Reflex 0.05590252892392751 Reflex Plus 9.214702569878161E-4 Semi-empirical 0.007269376471792772 Sorption 0.0578478550220129 Synthia 0.0015357837616463601 TURBOMOLE 5.119279205487867E-4 VAMP 0.0013310125934268455 Visualization 0.7332855533940821 X-Cell 0.0013310125934268455 ZDOCK 0.025596396027439336

Year

2022 0.06423734853884533 2023 0.23316108339272987 2024 0.6672309337134711 2025 1.0 2026 0.37874198146828225 2027 0.0

Keywords

target 1.0 potential 0.2747714125769733 docking 0.19266654226534802 analysis 0.18786154133233812 visualization 0.17559246128008957 between 0.16052435155812653 energy 0.0988990483299123 novel 0.09852584437395036 cell 0.06652360515021459 promising 0.05961933196491883 binding 0.05882627355849972 activity 0.041192386639298376 performance 0.040352677738384024 stability 0.03816010449710767 experimental 0.034334763948497854 interaction 0.03195558872924053 synthesized 0.026077626422840082 effective 0.0198264601604777 mechanism 0.019359955215525283 including 0.018753498787087142 development 0.018053741369658517 synthesis 0.006531069229333831 protein 0.005924612800895689 design 0.002799029669714499 enhanced 0.0
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