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Application

Discovery Studio 0.8360588716271463 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06496725084085679 Amorphous Cell 0.2858913081961409 Blends 0.002301292264117543 CASTEP 0.3662595149583997 CDOCKER 0.14869888475836432 CHARMm 0.24145866525048681 COMPASS 0.3598867056116127 COMPASS III 0.09877854487519915 COSMObase 0.004602584528235086 COSMOconf 0.004779607010090282 COSMOmic 1.770224818551956E-4 COSMOperm 0.0010621348911311736 COSMOplex 1.770224818551956E-4 COSMOquick 0.0015932023366967605 COSMOtherm 0.06231191361302885 Catalyst 0.0766507346432997 Classical Simulations 1.0 Conformers 7.080899274207824E-4 Crystallization 0.07541157727031333 DFTB Plus 0.004071517082669499 DMol3 0.16764029031687025 DPD 0.0024783147459727386 Discover 0.0038944946008143033 Forcite 0.5469994689325545 GULP 0.022658877677465036 Kinetix 0.0 LUDI 0.0026553372278279343 LibDock 0.06284298105859444 LigandFit 0.0033634271552487167 MCSS 0.0 MODELER 0.2255266418835192 MesoDyn 5.310674455655868E-4 Mesocite 0.0033634271552487167 Mesoscale 0.0060187643830766505 Modules 0.0 Morphology 0.01734820322180917 ONETEP 8.851124092759781E-4 Polymorph 0.002124269782262347 QMERA 1.770224818551956E-4 QSAR 5.310674455655868E-4 Quantum Mechanics 0.5229244114002478 Reflex 0.05523101433882103 Reflex Plus 0.0012391573729863693 Semi-empirical 0.005487696937511064 Sorption 0.05735528412108338 Synthia 0.0010621348911311736 TURBOMOLE 1.770224818551956E-4 VAMP 8.851124092759781E-4 Visualization 0.652504868118251 X-Cell 0.0014161798548415648 ZDOCK 0.0242520800141618

Year

2023 0.021782441227254614 2024 0.3663169079559038 2025 1.0 2026 0.5427015539912339 2027 0.0

Keywords

target 1.0 potential 0.29557337051237365 analysis 0.21078773091669573 docking 0.19623562216800278 between 0.15972464273265946 visualization 0.1551934471941443 energy 0.10003485535029627 novel 0.09803067270826071 promising 0.08687696061345417 cell 0.0721505751132799 binding 0.06631230393865459 performance 0.05341582432903451 stability 0.05036598117811084 activity 0.04069362147089578 including 0.027448588358313 experimental 0.025270128964796097 effective 0.02474729871035204 development 0.02108748692924364 interaction 0.02082607180202161 mechanism 0.020216103171836877 synthesized 0.019867549668874173 enhanced 0.015510630881840362 strong 0.009933774834437087 design 0.004182642035552457 synthesis 0.0
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