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Application

Discovery Studio 1.0 Materials Studio 0.9449284892322867 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05866388308977036 Amorphous Cell 0.2745302713987474 Blends 0.0025052192066805845 CASTEP 0.3246346555323591 CDOCKER 0.17599164926931107 CHARMm 0.2797494780793319 COMPASS 0.3348643006263048 COMPASS III 0.10438413361169102 COSMObase 0.004801670146137787 COSMOconf 0.005845511482254697 COSMOmic 0.0 COSMOperm 4.175365344467641E-4 COSMOplex 2.0876826722338206E-4 COSMOquick 8.350730688935282E-4 COSMOtherm 0.06367432150313153 Catalyst 0.08538622129436325 Classical Simulations 1.0 Conformers 4.175365344467641E-4 Crystallization 0.07181628392484342 DFTB Plus 0.003966597077244259 DMol3 0.14759916492693112 DPD 0.0022964509394572024 Discover 0.0041753653444676405 Forcite 0.5183716075156576 GULP 0.016910229645093946 Kinetix 2.0876826722338206E-4 LUDI 0.003966597077244259 LibDock 0.07390396659707725 LigandFit 0.004384133611691023 MCSS 2.0876826722338206E-4 MODELER 0.26137787056367434 MesoDyn 6.263048016701461E-4 Mesocite 0.0029227557411273487 Mesoscale 0.005636743215031315 Modules 0.0 Morphology 0.0162839248434238 ONETEP 8.350730688935282E-4 Polymorph 0.0022964509394572024 QMERA 2.0876826722338206E-4 QSAR 4.175365344467641E-4 Quantum Mechanics 0.46346555323590816 Reflex 0.05198329853862213 Reflex Plus 8.350730688935282E-4 Semi-empirical 0.005636743215031315 Sorption 0.0569937369519833 Synthia 0.0010438413361169101 TURBOMOLE 2.0876826722338206E-4 VAMP 0.0010438413361169101 Visualization 0.7269311064718162 X-Cell 0.0012526096033402922 ZDOCK 0.02964509394572025

Year

2023 0.0 2024 0.4755532681420484 2025 1.0 2026 0.71161434208269 2027 1.7155601303825698E-4

Keywords

target 1.0 potential 0.30766165188801436 docking 0.23253960346717145 analysis 0.22018531433695326 visualization 0.17246189100328785 between 0.14526252864401715 novel 0.09773836803825844 promising 0.08857228255454817 binding 0.0783102520673508 energy 0.070339742951081 cell 0.060177343827837 activity 0.05380093653482116 stability 0.04064959649297599 performance 0.03387466374414666 including 0.02341337052904254 synthesized 0.018431802331373915 development 0.01773438278370031 effective 0.017236225963933448 mechanism 0.01623991232439972 experimental 0.012952077313938428 interaction 0.010859818670917605 enhanced 0.00946497957557039 strong 0.008767560027896783 protein 0.006575670020922586 synthesis 0.0
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