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Application

Discovery Studio 0.731176104542626 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057034220532319393 Amorphous Cell 0.30038022813688214 Blends 0.001520912547528517 CASTEP 0.26996197718631176 CDOCKER 0.12547528517110265 CHARMm 0.20228136882129277 COMPASS 0.36045627376425854 COMPASS III 0.132319391634981 COSMObase 0.003041825095057034 COSMOconf 0.00988593155893536 COSMOmic 0.0 COSMOperm 7.604562737642585E-4 COSMOplex 7.604562737642585E-4 COSMOtherm 0.06768060836501902 Catalyst 0.06311787072243347 Classical Simulations 1.0 Conformers 7.604562737642585E-4 Crystallization 0.08593155893536121 DFTB Plus 0.003041825095057034 DMol3 0.1247148288973384 DPD 0.0022813688212927757 Discover 0.00532319391634981 Forcite 0.5764258555133079 GULP 0.00988593155893536 Kinetix 0.0 LUDI 7.604562737642585E-4 LibDock 0.05475285171102662 LigandFit 7.604562737642585E-4 MODELER 0.18022813688212927 Mesocite 0.00532319391634981 Mesoscale 0.006844106463878327 Morphology 0.019011406844106463 ONETEP 0.001520912547528517 Polymorph 0.0022813688212927757 Quantum Mechanics 0.3923954372623574 Reflex 0.061596958174904945 Reflex Plus 0.0 Semi-empirical 0.003041825095057034 Sorption 0.0699619771863118 Synthia 7.604562737642585E-4 TURBOMOLE 0.0 Visualization 0.5657794676806084 X-Cell 7.604562737642585E-4 ZDOCK 0.02129277566539924

Year

2025 0.7053872053872053 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.2755536626916525 analysis 0.2014480408858603 docking 0.17206132879045996 visualization 0.131175468483816 between 0.12776831345826234 energy 0.0821976149914821 promising 0.08091993185689948 performance 0.07538330494037479 cell 0.07112436115843271 novel 0.07027257240204429 binding 0.049403747870528106 strategy 0.04514480408858603 stability 0.04045996592844974 strong 0.034497444633730834 activity 0.03151618398637138 including 0.023424190800681432 mechanism 0.018313458262350937 enhanced 0.015332197614991482 effective 0.014906303236797274 synthesized 0.012776831345826235 experimental 0.009369676320272573 design 0.008943781942078365 development 0.0012776831345826234 efficient 0.0
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