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Application

Discovery Studio 1.0 Materials Studio 0.15563118811881188 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.015124555160142349 Amorphous Cell 0.02431791221826809 Blends 0.0 CASTEP 0.09252669039145907 CDOCKER 0.29626334519572955 CHARMm 0.3603202846975089 COMPASS 0.045966785290628705 COMPASS III 0.011565836298932384 COSMObase 8.896797153024911E-4 COSMOconf 0.0014827995255041518 COSMOperm 2.965599051008304E-4 COSMOtherm 0.020166073546856466 Catalyst 0.21648873072360617 Classical Simulations 0.4608540925266904 Conformers 2.965599051008304E-4 Crystallization 0.019869513641755633 DFTB Plus 0.0 DMol3 0.10972716488730723 DPD 0.0 Discover 2.965599051008304E-4 Forcite 0.06791221826809016 GULP 0.0026690391459074734 LUDI 0.005634638196915777 LibDock 0.11002372479240807 LigandFit 0.018386714116251483 MCSS 0.0014827995255041518 MODELER 0.297153024911032 Mesocite 5.931198102016608E-4 Mesoscale 5.931198102016608E-4 Morphology 0.0020759193357058124 ONETEP 2.965599051008304E-4 Polymorph 0.0 QMERA 2.965599051008304E-4 QSAR 5.931198102016608E-4 Quantum Mechanics 0.1981020166073547 Reflex 0.01749703440094899 Semi-empirical 0.0011862396204033216 Sorption 0.003855278766310795 VAMP 2.965599051008304E-4 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03469750889679715

Year

2016 0.0 2017 0.0748663101604278 2018 0.11645870469399881 2019 0.12834224598930483 2020 0.15508021390374332 2021 0.21093285799168152 2022 0.43137254901960786 2023 0.7700534759358288 2024 1.0 2025 0.8330362448009507 2026 0.058823529411764705

Keywords

activity 1.0 target 0.9681449094316052 docking 0.4465958775765147 potential 0.34072454715802625 visualization 0.3291692692067458 analysis 0.19378513429106808 novel 0.16895690193628982 binding 0.14959400374765772 vitro 0.12382885696439726 compound 0.09931292941911306 inhibition 0.09587757651467832 synthesis 0.09400374765771392 synthesized 0.08697688944409744 protein 0.08447845096814491 promising 0.06386633354153654 between 0.061992504684572146 silico 0.060587133041848845 potent 0.047470331043098064 active 0.04325421611492817 treatment 0.03263585259212992 drug 0.02763897564022486 development 0.01764522173641474 interaction 0.014053716427232979 enzyme 0.01358525921299188 mechanism 0.0
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