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Application

Discovery Studio 0.9864846228106469 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059493016037247805 Amorphous Cell 0.28556647697878945 Blends 0.0020693222969477496 CASTEP 0.34643904121400243 CDOCKER 0.16554578375581996 CHARMm 0.26107949646490775 COMPASS 0.3476461458872219 COMPASS III 0.10312122779789619 COSMObase 0.004483531643386791 COSMOconf 0.0055181927918606655 COSMOmic 1.724435247456458E-4 COSMOperm 5.173305742369374E-4 COSMOplex 1.724435247456458E-4 COSMOquick 0.0013795481979651664 COSMOtherm 0.06621831350232799 Catalyst 0.09070529401620969 Classical Simulations 1.0 Conformers 3.448870494912916E-4 Crystallization 0.0722538368684256 DFTB Plus 0.0037937575444042075 DMol3 0.15864804276599415 DPD 0.0018968787722021038 Discover 0.0037937575444042075 Forcite 0.5328504914640455 GULP 0.01965856182100362 Kinetix 1.724435247456458E-4 LUDI 0.0036213140196585617 LibDock 0.0700120710467322 LigandFit 0.004311088118641145 MCSS 3.448870494912916E-4 MODELER 0.242455595792378 MesoDyn 5.173305742369374E-4 Mesocite 0.002586652871184687 Mesoscale 0.004828418692878082 Modules 0.0 Morphology 0.01724435247456458 ONETEP 8.62217623728229E-4 Polymorph 0.0020693222969477496 QMERA 1.724435247456458E-4 QSAR 6.897740989825832E-4 Quantum Mechanics 0.4949129160200034 Reflex 0.05225038799793068 Reflex Plus 0.0010346611484738748 Semi-empirical 0.0055181927918606655 Sorption 0.05776858078979134 Synthia 0.0010346611484738748 TURBOMOLE 1.724435247456458E-4 VAMP 0.0012071046732195206 Visualization 0.738575616485601 X-Cell 0.0015519917227108122 ZDOCK 0.027763407484048975

Year

2023 0.0700310349480502 2024 0.4585076238024558 2025 1.0 2026 0.57117797868034 2027 0.0

Keywords

target 1.0 potential 0.2982512692400677 docking 0.21718107824965752 analysis 0.20912241115319527 visualization 0.1744701426384076 between 0.14940768796841003 novel 0.09759045853815779 energy 0.0814731243452333 promising 0.07945845757111773 binding 0.07148037714562011 cell 0.06430816342976872 activity 0.04972197598517205 stability 0.03964864211459425 performance 0.038439842050124906 including 0.020871947779837214 synthesized 0.020871947779837214 experimental 0.018373760979933918 development 0.016600854218712224 mechanism 0.014827947457490531 effective 0.014666774115561287 interaction 0.014022080747844307 enhanced 0.009186880489966959 protein 0.0037069868643726327 strong 0.002498186799903296 design 0.0
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