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Application

Discovery Studio 0.4041773543422499 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05860901276374056 Amorphous Cell 0.27012242771555095 Blends 0.0023443605105496223 CASTEP 0.016150039072675176 CDOCKER 0.0804897108622037 CHARMm 0.28809585829643136 COMPASS 0.3313362854910133 COMPASS III 0.09325345141964053 COSMOplex 0.0 COSMOtherm 7.814535035165407E-4 Catalyst 0.015889554571502994 Classical Simulations 1.0 Conformers 5.209690023443605E-4 Crystallization 0.03490492315707215 DFTB Plus 0.0015629070070330815 DMol3 0.03073717113831727 DPD 0.0013024225058609013 Discover 0.005209690023443605 Forcite 0.5084657462880958 GULP 0.016931492576191715 LUDI 0.0026048450117218025 LibDock 0.022922636103151862 LigandFit 0.0026048450117218025 MODELER 0.046626725709820266 MesoDyn 0.0 Mesocite 0.0015629070070330815 Mesoscale 0.003125814014066163 Morphology 0.016410523573847355 Polymorph 0.0023443605105496223 QMERA 2.6048450117218026E-4 Quantum Mechanics 0.04532430320395937 Reflex 0.015368585569158636 Reflex Plus 0.0 Semi-empirical 0.0026048450117218025 Sorption 0.054701745246157854 Synthia 5.209690023443605E-4 VAMP 2.6048450117218026E-4 ZDOCK 0.009116957541026309

Year

2024 0.1557338367154318 2025 0.6451156205757432 2026 1.0 2027 0.0

Keywords

target 1.0 cell 0.24656084656084656 between 0.20282186948853614 potential 0.18483245149911817 amorphous 0.18342151675485008 performance 0.13932980599647266 energy 0.12980599647266314 analysis 0.12839506172839507 enhanced 0.057495590828924165 novel 0.057495590828924165 strategy 0.055379188712522044 docking 0.05432098765432099 stability 0.04479717813051146 experimental 0.043033509700176366 mechanism 0.04126984126984127 promising 0.04056437389770723 adsorption 0.033156966490299825 design 0.026102292768959437 surface 0.02292768959435626 efficient 0.015167548500881834 effective 0.01199294532627866 interaction 0.01199294532627866 development 0.006701940035273368 binding 0.004232804232804233 stable 0.0
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