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Application

Discovery Studio 0.8831131533601378 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059175766114829165 Amorphous Cell 0.28531172948221206 Blends 0.0021134202183867557 CASTEP 0.31595632264882 CDOCKER 0.15780204297287778 CHARMm 0.2476224022543149 COMPASS 0.350475519549137 COMPASS III 0.11306798168369143 COSMObase 0.005635787249031349 COSMOconf 0.0063402606551602675 COSMOmic 0.0 COSMOperm 7.044734061289186E-4 COSMOplex 3.522367030644593E-4 COSMOquick 7.044734061289186E-4 COSMOtherm 0.06657273687918282 Catalyst 0.06692497358224728 Classical Simulations 1.0 Conformers 3.522367030644593E-4 Crystallization 0.073617470940472 DFTB Plus 0.0028178936245156746 DMol3 0.14864388869320183 DPD 0.0014089468122578373 Discover 0.005635787249031349 Forcite 0.5382176822824938 GULP 0.016907361747094046 Kinetix 0.0 LUDI 0.0031701303275801338 LibDock 0.06692497358224728 LigandFit 0.0031701303275801338 MODELER 0.2363508277562522 MesoDyn 7.044734061289186E-4 Mesocite 0.0038746037337090526 Mesoscale 0.005635787249031349 Morphology 0.01655512504402959 ONETEP 7.044734061289186E-4 Polymorph 0.0028178936245156746 QMERA 3.522367030644593E-4 QSAR 0.0 Quantum Mechanics 0.45685100387460376 Reflex 0.05318774216273336 Reflex Plus 3.522367030644593E-4 Semi-empirical 0.004226840436773511 Sorption 0.060232476224022544 Synthia 7.044734061289186E-4 TURBOMOLE 0.0 VAMP 3.522367030644593E-4 Visualization 0.6294469883761888 X-Cell 0.0010567101091933778 ZDOCK 0.027474462839027828

Year

2024 0.04675758419148344 2025 0.935986640690231 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.31841359773371103 analysis 0.22681775259678943 docking 0.20944287063267233 visualization 0.15089707271010386 between 0.14183191690273844 promising 0.10198300283286119 novel 0.09102927289896129 energy 0.0874409820585458 cell 0.06968838526912181 binding 0.06855524079320113 performance 0.05250236071765817 stability 0.05004721435316336 activity 0.045514636449480644 strong 0.036827195467422094 including 0.030406043437204912 enhanced 0.025118035882908403 effective 0.020585457979225685 development 0.0169971671388102 strategy 0.016808309726156753 mechanism 0.013597733711048159 synthesized 0.0113314447592068 experimental 0.0084985835694051 design 0.0066100094428706326 interaction 0.0
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