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Application

Discovery Studio 0.8553377773355885 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06840089792684537 Amorphous Cell 0.2906377921563449 Blends 0.0025089132444209693 CASTEP 0.38478806285487915 CDOCKER 0.14881816981381224 CHARMm 0.2361019411065628 COMPASS 0.3674897662749241 COMPASS III 0.09216954971609666 COSMObase 0.0036973458338835337 COSMOconf 0.00528192261983362 COSMOmic 0.0 COSMOperm 7.92288392975043E-4 COSMOplex 2.6409613099168095E-4 COSMOquick 0.0011884325894625644 COSMOtherm 0.06668427307539944 Cantera 0.0 Catalyst 0.09943219331836789 Classical Simulations 1.0 Conformers 5.281922619833619E-4 Crystallization 0.07513534926713324 DFTB Plus 0.0060742110128086625 DMol3 0.17311501386504688 DPD 0.00277300937541265 Discover 0.0038293938993793743 Forcite 0.5528852502310841 GULP 0.02165588274131784 Kinetix 2.6409613099168095E-4 LUDI 0.0038293938993793743 LibDock 0.061930542717549185 LigandFit 0.004357586161362736 MCSS 5.281922619833619E-4 MODELER 0.19424270434438135 MesoDyn 7.92288392975043E-4 Mesocite 0.003301201637396012 Mesoscale 0.006206259078304503 Modules 0.0 Morphology 0.017826488841938465 ONETEP 0.0010563845239667238 Polymorph 0.0019807209824376074 QMERA 2.6409613099168095E-4 QSAR 0.0010563845239667238 Quantum Mechanics 0.5478674237422422 Reflex 0.05440380298428628 Reflex Plus 7.92288392975043E-4 Semi-empirical 0.00805493199524627 Sorption 0.05730886042519477 Synthia 0.0014525287204542453 TURBOMOLE 5.281922619833619E-4 VAMP 0.0014525287204542453 Visualization 0.7164928033804305 X-Cell 0.001320480654958405 ZDOCK 0.026277565033672255

Year

2022 0.006499327655759749 2023 0.2162707306140744 2024 0.5603989242492156 2025 1.0 2026 0.47568354997758855 2027 0.0

Keywords

target 1.0 potential 0.27996559562572954 docking 0.19628924248940222 analysis 0.19291024144498373 visualization 0.16962585242980893 between 0.15703139399152177 energy 0.09627081157461449 novel 0.09375191988695705 cell 0.06739571174049272 promising 0.06555262026171899 binding 0.06149781900841678 activity 0.04355839528168581 performance 0.041653867420286296 stability 0.03944215764575782 experimental 0.029305154512502304 synthesized 0.02475886219819377 interaction 0.022977207102045833 effective 0.018983842231369417 including 0.018123732874608344 mechanism 0.01671069607421515 development 0.016219205013208823 enhanced 0.004239110401179578 synthesis 0.0025803280702832217 design 0.002027400626651103 protein 0.0
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