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Application

Discovery Studio 1.0 Materials Studio 0.9494693489624584 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057633973710819006 Amorphous Cell 0.27927199191102126 Blends 0.002224469160768453 CASTEP 0.32922143579373103 CDOCKER 0.1743174924165824 CHARMm 0.2758341759352882 COMPASS 0.33872598584428715 COMPASS III 0.1019211324570273 COSMObase 0.004651162790697674 COSMOconf 0.005460060667340748 COSMOmic 0.0 COSMOperm 4.044489383215369E-4 COSMOplex 2.0222446916076846E-4 COSMOquick 0.0010111223458038423 COSMOtherm 0.0641051567239636 Catalyst 0.0897876643073812 Classical Simulations 1.0 Conformers 4.044489383215369E-4 Crystallization 0.07138523761375126 DFTB Plus 0.004246713852376138 DMol3 0.1524772497472194 DPD 0.002224469160768453 Discover 0.004246713852376138 Forcite 0.5211324570273003 GULP 0.018604651162790697 Kinetix 2.0222446916076846E-4 LUDI 0.003640040444893832 LibDock 0.0705763397371082 LigandFit 0.004448938321536906 MCSS 0.0 MODELER 0.26046511627906976 MesoDyn 6.066734074823053E-4 Mesocite 0.0028311425682507585 Mesoscale 0.005460060667340748 Modules 0.0 Morphology 0.01678463094034378 ONETEP 0.0010111223458038423 Polymorph 0.0024266936299292214 QMERA 2.0222446916076846E-4 QSAR 6.066734074823053E-4 Quantum Mechanics 0.4725985844287159 Reflex 0.05116279069767442 Reflex Plus 8.088978766430738E-4 Semi-empirical 0.005662285136501517 Sorption 0.056622851365015166 Synthia 0.0010111223458038423 TURBOMOLE 2.0222446916076846E-4 VAMP 8.088978766430738E-4 Visualization 0.742366026289181 X-Cell 0.0012133468149646107 ZDOCK 0.02891809908998989

Year

2023 0.016786179921773142 2024 0.4758800521512386 2025 1.0 2026 0.6678617992177314 2027 0.0

Keywords

target 1.0 potential 0.3088235294117647 docking 0.2315455594002307 analysis 0.2180891964628989 visualization 0.17570165321030373 between 0.144559784698193 novel 0.09630911188004614 promising 0.08391003460207612 binding 0.07622068435217225 energy 0.07247212610534409 cell 0.06084198385236447 activity 0.05392156862745098 stability 0.03815840061514802 performance 0.033256439830834296 including 0.019896193771626297 synthesized 0.01826220684352172 development 0.016724336793540944 effective 0.014994232987312572 mechanism 0.014225297962322183 experimental 0.011437908496732025 interaction 0.00980392156862745 enhanced 0.006920415224913495 strong 0.004709727028066129 protein 0.004325259515570935 synthesis 0.0
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