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Application

Discovery Studio 0.9922915206727401 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0631238990017616 Amorphous Cell 0.2796535525543159 Blends 0.002201996476805637 CASTEP 0.3565766294773928 CDOCKER 0.16632413388138578 CHARMm 0.26746917204932474 COMPASS 0.34512624779800355 COMPASS III 0.09497944803288315 COSMObase 0.0042571931884908985 COSMOconf 0.005284791544333529 COSMOmic 0.0 COSMOperm 5.871990604815032E-4 COSMOplex 1.467997651203758E-4 COSMOquick 0.001467997651203758 COSMOtherm 0.06356429829712272 Cantera 0.0 Catalyst 0.09923664122137404 Classical Simulations 1.0 Conformers 7.33998825601879E-4 Crystallization 0.07178508514386377 DFTB Plus 0.00455079271873165 DMol3 0.15971814445096888 DPD 0.002201996476805637 Discover 0.0035231943628890195 Forcite 0.530093951849677 GULP 0.019671168526130357 Kinetix 1.467997651203758E-4 LUDI 0.003963593658250147 LibDock 0.0697298884321785 LigandFit 0.004110393423370522 MCSS 5.871990604815032E-4 MODELER 0.22959483264826777 MesoDyn 7.33998825601879E-4 Mesocite 0.0033763945977686436 Mesoscale 0.005871990604815032 Modules 0.0 Morphology 0.01614797416324134 ONETEP 0.0010275983558426305 Polymorph 0.0019083969465648854 QMERA 1.467997651203758E-4 QSAR 7.33998825601879E-4 Quantum Mechanics 0.5063123899001761 Reflex 0.05255431591309454 Reflex Plus 8.807985907222549E-4 Semi-empirical 0.006165590135055784 Sorption 0.05593071051086318 Synthia 8.807985907222549E-4 TURBOMOLE 4.4039929536112744E-4 VAMP 0.0011743981209630064 Visualization 0.7510275983558427 X-Cell 0.0016147974163241339 ZDOCK 0.02759835584263065

Year

2023 0.12359550561797752 2024 0.4801952105322892 2025 1.0 2026 0.4818976279650437 2027 0.0

Keywords

target 1.0 potential 0.29607456289543505 docking 0.22130757194366965 analysis 0.20708891761344309 visualization 0.18008027756990272 between 0.14973807742023268 novel 0.0980338798557725 energy 0.07946118783590721 promising 0.07347438601265392 binding 0.07007279406762365 cell 0.06095652765494251 activity 0.04939111504183958 stability 0.04027484862915845 performance 0.034560174161507584 synthesized 0.02170215660929315 including 0.02095380638138649 experimental 0.020681679025784067 interaction 0.019321042247771956 effective 0.016803864208449554 mechanism 0.015239131913735628 development 0.014967004558133207 protein 0.010408871351792639 enhanced 0.0036056874617320907 synthesis 0.0033335601061296686 design 0.0
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