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Application

Discovery Studio 0.7953095684803002 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06861780619773733 Amorphous Cell 0.2988194786030497 Blends 0.001721593703885883 CASTEP 0.36153467781603543 CDOCKER 0.14436792916871619 CHARMm 0.22282341367437286 COMPASS 0.3644859813084112 COMPASS III 0.10378750614854894 COSMObase 0.004181013280865716 COSMOconf 0.006640432857845549 COSMOmic 0.0 COSMOperm 0.0012297097884899164 COSMOplex 2.4594195769798326E-4 COSMOquick 7.378258730939498E-4 COSMOtherm 0.07230693556320708 Catalyst 0.07747171667486473 Classical Simulations 1.0 Conformers 4.918839153959665E-4 Crystallization 0.07697983275946876 DFTB Plus 0.004918839153959666 DMol3 0.161583866207575 DPD 0.002459419576979833 Discover 0.003935071323167732 Forcite 0.5668962124938515 GULP 0.01647811116576488 Kinetix 2.4594195769798326E-4 LUDI 0.0036891293654697493 LibDock 0.05853418593212002 LigandFit 0.002951303492375799 MCSS 4.918839153959665E-4 MODELER 0.2147073290703394 MesoDyn 2.4594195769798326E-4 Mesocite 0.0031972454500737825 Mesoscale 0.005656665027053615 Morphology 0.018691588785046728 ONETEP 0.0012297097884899164 Polymorph 0.0012297097884899164 QMERA 0.0 QSAR 7.378258730939498E-4 Quantum Mechanics 0.515248401377275 Reflex 0.05533694048204624 Reflex Plus 7.378258730939498E-4 Semi-empirical 0.006886374815543532 Sorption 0.058780127889818005 Synthia 0.0012297097884899164 TURBOMOLE 4.918839153959665E-4 VAMP 0.0014756517461878996 Visualization 0.6455976389572061 X-Cell 0.001721593703885883 ZDOCK 0.02459419576979833

Year

2023 7.336757153338225E-4 2024 0.35051357300073366 2025 1.0 2026 0.5638297872340425 2027 0.0

Keywords

target 1.0 potential 0.278756846868302 analysis 0.19742795903786617 docking 0.17992379137889974 between 0.14896403905691832 visualization 0.14455822814955943 energy 0.08799714217670875 novel 0.0849011669445106 promising 0.07061205048821148 cell 0.06799237913788997 performance 0.05417956656346749 binding 0.05251250297689926 stability 0.038342462491069304 activity 0.03619909502262444 experimental 0.025244105739461776 synthesized 0.019647535127411287 including 0.01940938318647297 enhanced 0.016313407954274828 effective 0.01607525601333651 mechanism 0.015241724220052393 development 0.011193141224100976 strong 0.00690640628721124 interaction 0.006787330316742082 design 0.0 strategy 0.0
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