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Application

Discovery Studio 1.0 Materials Studio 0.9088210347752332 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.052576235541535225 Amorphous Cell 0.26708727655099895 Blends 0.0026288117770767614 CASTEP 0.26235541535226076 CDOCKER 0.1808622502628812 CHARMm 0.28286014721345953 COMPASS 0.33175604626708727 COMPASS III 0.11356466876971609 COSMObase 0.0026288117770767614 COSMOconf 0.006834910620399579 COSMOmic 0.0 COSMOperm 5.257623554153522E-4 COSMOplex 5.257623554153522E-4 COSMOtherm 0.058885383806519455 Catalyst 0.0804416403785489 Classical Simulations 1.0 Conformers 5.257623554153522E-4 Crystallization 0.07570977917981073 DFTB Plus 0.002103049421661409 DMol3 0.12407991587802314 DPD 0.0015772870662460567 Discover 0.003680336487907466 Forcite 0.5199789695057834 GULP 0.011041009463722398 Kinetix 0.0 LUDI 0.002103049421661409 LibDock 0.07413249211356467 LigandFit 0.004206098843322818 MODELER 0.25341745531019977 Mesocite 0.004206098843322818 Mesoscale 0.005257623554153523 Morphology 0.016824395373291272 ONETEP 0.0010515247108307045 Polymorph 0.002103049421661409 QMERA 0.0 Quantum Mechanics 0.38275499474237645 Reflex 0.055205047318611984 Reflex Plus 0.0 Semi-empirical 0.0031545741324921135 Sorption 0.0583596214511041 Synthia 0.0010515247108307045 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.6929547844374343 X-Cell 0.0015772870662460567 ZDOCK 0.031545741324921134

Year

2025 1.0 2026 0.9606331168831169 2027 0.0

Keywords

target 1.0 potential 0.32528828104049345 docking 0.2386698846875838 analysis 0.22392062215071065 visualization 0.17135961383748993 between 0.1300616787342451 promising 0.09814963797264682 novel 0.09761330115312417 binding 0.08313220702601233 cell 0.060874229015821936 activity 0.056851702869401985 energy 0.05551086082059534 stability 0.04129793510324484 strong 0.03888441941539287 including 0.037275408956824886 performance 0.03459372485921158 development 0.02413515687851971 therapeutic 0.022794314829713058 mechanism 0.02172164119066774 strategy 0.01850362027353178 enhanced 0.015553767766157146 synthesized 0.013140252078305176 effective 0.012335746849021185 design 0.0016090104585679806 interaction 0.0
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