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Application

Discovery Studio 1.0 Materials Studio 0.5755143000501756 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.047038327526132406 Amorphous Cell 0.23954703832752614 Blends 8.710801393728223E-4 CASTEP 0.2604529616724739 CDOCKER 0.2691637630662021 CHARMm 0.4155052264808362 COMPASS 0.29181184668989546 COMPASS III 0.06358885017421603 COSMObase 0.0017421602787456446 COSMOconf 0.0017421602787456446 COSMOmic 0.0 COSMOperm 8.710801393728223E-4 COSMOplex 0.0 COSMOquick 0.004355400696864111 COSMOtherm 0.050522648083623695 Catalyst 0.18902439024390244 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.05226480836236934 DFTB Plus 0.0017421602787456446 DMol3 0.1602787456445993 DPD 8.710801393728223E-4 Discover 8.710801393728223E-4 Forcite 0.4259581881533101 GULP 0.010452961672473868 LUDI 0.013937282229965157 LibDock 0.10888501742160278 LigandFit 0.01132404181184669 MCSS 0.0017421602787456446 MODELER 0.3127177700348432 MesoDyn 0.0 Mesocite 0.002613240418118467 Mesoscale 0.005226480836236934 Morphology 0.013066202090592335 ONETEP 0.0017421602787456446 Polymorph 8.710801393728223E-4 QSAR 0.0017421602787456446 Quantum Mechanics 0.4102787456445993 Reflex 0.037456445993031356 Reflex Plus 0.0 Semi-empirical 0.0017421602787456446 Sorption 0.037456445993031356 Synthia 0.0 Visualization 0.8562717770034843 X-Cell 0.0 ZDOCK 0.04790940766550523

Year

2022 0.0 2023 0.21654135338345865 2024 0.6593984962406015 2025 1.0 2026 0.2954887218045113

Keywords

development 1.0 target 0.9417056495142138 potential 0.3717164447643037 docking 0.27527887729399064 novel 0.21950341849586183 analysis 0.18675782655631523 visualization 0.1597697013314142 promising 0.1165887009715725 binding 0.10399424253328536 between 0.10291471752428931 activity 0.0784454839870457 effective 0.05037783375314862 protein 0.0456998920474991 design 0.04354084202950702 cell 0.03850305865419216 therapeutic 0.037783375314861464 including 0.026628283555235697 drug 0.025908600215905003 stability 0.01943145016192875 compound 0.01439366678661389 treatment 0.01439366678661389 interaction 0.014033825116948543 mechanism 0.006477150053976251 performance 0.0025188916876574307 synthesized 0.0
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