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Application

Discovery Studio 1.0 Materials Studio 0.8589657488247145 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057108863771564544 Amorphous Cell 0.26442593694229627 Blends 0.001784651992861392 CASTEP 0.2956573468173706 CDOCKER 0.185901249256395 CHARMm 0.30160618679357526 COMPASS 0.32569898869720404 COMPASS III 0.1023200475907198 COSMObase 0.005056513979773944 COSMOconf 0.005651397977394408 COSMOmic 0.0 COSMOperm 5.94883997620464E-4 COSMOplex 2.97441998810232E-4 COSMOquick 8.92325996430696E-4 COSMOtherm 0.06067816775728733 Catalyst 0.08417608566329565 Classical Simulations 1.0 Conformers 2.97441998810232E-4 Crystallization 0.06930398572278405 DFTB Plus 0.002676977989292088 DMol3 0.1403926234384295 DPD 0.002082093991671624 Discover 0.00446162998215348 Forcite 0.5026769779892921 GULP 0.0148720999405116 Kinetix 0.0 LUDI 0.00446162998215348 LibDock 0.07584770969660916 LigandFit 0.003569303985722784 MODELER 0.2825698988697204 MesoDyn 0.0 Mesocite 0.003569303985722784 Mesoscale 0.005353955978584176 Morphology 0.015764425936942297 ONETEP 8.92325996430696E-4 Polymorph 0.002379535990481856 QMERA 2.97441998810232E-4 QSAR 2.97441998810232E-4 Quantum Mechanics 0.42891136228435456 Reflex 0.049970255800118976 Reflex Plus 5.94883997620464E-4 Semi-empirical 0.003866745984533016 Sorption 0.054431885782272454 Synthia 5.94883997620464E-4 TURBOMOLE 0.0 VAMP 2.97441998810232E-4 Visualization 0.7382510410469958 X-Cell 0.00148720999405116 ZDOCK 0.030933967876264127

Year

2024 0.2750865051903114 2025 1.0 2026 0.9285714285714286 2027 0.0

Keywords

target 1.0 potential 0.3336792173139638 docking 0.259264749481174 analysis 0.23821523865994665 visualization 0.1812926178476134 between 0.13726652831307443 promising 0.09709457456270383 novel 0.09561221464571598 binding 0.09368514675363178 energy 0.05988734064630893 cell 0.05973910465461014 activity 0.05870145271271865 stability 0.04061666172546694 including 0.026682478505781204 performance 0.023421286688407945 strong 0.02297657871331159 effective 0.019270678920841982 development 0.015713015120071155 synthesized 0.015416543136673585 protein 0.010080047435517344 enhanced 0.008745923510228284 mechanism 0.007560035576638008 therapeutic 0.006670619626445301 interaction 0.005040023717758672 strategy 0.0
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