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Application

Discovery Studio 0.7889723780294211 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06650731158605175 Amorphous Cell 0.2937289088863892 Blends 0.002109111361079865 CASTEP 0.3787964004499438 CDOCKER 0.14102924634420697 CHARMm 0.22764341957255343 COMPASS 0.3669853768278965 COMPASS III 0.09884701912260968 COSMObase 0.00421822272215973 COSMOconf 0.005343082114735658 COSMOmic 1.4060742407199101E-4 COSMOperm 0.0011248593925759281 COSMOplex 1.4060742407199101E-4 COSMOquick 0.001546681664791901 COSMOtherm 0.06805399325084364 Cantera 0.0 Catalyst 0.078177727784027 Classical Simulations 1.0 Conformers 4.21822272215973E-4 Crystallization 0.0735376827896513 DFTB Plus 0.005343082114735658 DMol3 0.16943194600674916 DPD 0.0022497187851518562 Discover 0.003655793025871766 Forcite 0.5608830146231721 GULP 0.020247469066366704 Kinetix 1.4060742407199101E-4 LUDI 0.002952755905511811 LibDock 0.059476940382452194 LigandFit 0.003515185601799775 MCSS 4.21822272215973E-4 MODELER 0.21681664791901012 MesoDyn 7.03037120359955E-4 Mesocite 0.002952755905511811 Mesoscale 0.0054836895388076495 Modules 0.0 Morphology 0.017435320584926885 ONETEP 0.0011248593925759281 Polymorph 0.001968503937007874 QMERA 1.4060742407199101E-4 QSAR 9.84251968503937E-4 Quantum Mechanics 0.5376827896512936 Reflex 0.0531496062992126 Reflex Plus 0.001265466816647919 Semi-empirical 0.006889763779527559 Sorption 0.05849268841394826 Synthia 0.00140607424071991 TURBOMOLE 4.21822272215973E-4 VAMP 0.0011248593925759281 Visualization 0.6473565804274466 X-Cell 0.001546681664791901 ZDOCK 0.024887514060742407

Year

2023 0.017013039934800325 2024 0.42226976365118174 2025 1.0 2026 0.4328647106764466 2027 0.0

Keywords

target 1.0 potential 0.28471940500338067 analysis 0.19891818796484112 docking 0.1815415821501014 between 0.1636916835699797 visualization 0.1499661933739013 energy 0.10229885057471265 novel 0.09425287356321839 promising 0.0777552400270453 cell 0.0724814063556457 binding 0.0581473968897904 performance 0.056795131845841784 stability 0.04590939824205544 activity 0.03867478025693036 experimental 0.03231913455037187 including 0.02542258282623394 synthesized 0.023123732251521298 effective 0.022988505747126436 mechanism 0.020757268424611224 interaction 0.019945909398242055 development 0.018187964841108857 enhanced 0.01744421906693712 design 0.005544286680189317 strong 0.003989181879648411 synthesis 0.0
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