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Application

Discovery Studio 1.0 Materials Studio 0.6796959826275787 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.045879354290569246 Amorphous Cell 0.24723874256584538 Blends 0.0016992353440951572 CASTEP 0.27697536108751064 CDOCKER 0.2497875955819881 CHARMm 0.37553101104502973 COMPASS 0.3160577740016992 COMPASS III 0.06542056074766354 COSMObase 0.0033984706881903144 COSMOconf 0.002548853016142736 COSMOmic 0.0 COSMOperm 0.002548853016142736 COSMOplex 0.0 COSMOquick 0.004248088360237893 COSMOtherm 0.06287170773152082 Catalyst 0.16907391673746813 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.05437553101104503 DFTB Plus 0.0033984706881903144 DMol3 0.17926932880203908 DPD 0.0016992353440951572 Discover 0.002548853016142736 Forcite 0.46559048428207306 GULP 0.010195412064570943 LUDI 0.0076465590484282074 LibDock 0.10535259133389975 LigandFit 0.011045029736618521 MCSS 0.0 MODELER 0.3058623619371283 MesoDyn 0.0 Mesocite 8.496176720475786E-4 Mesoscale 0.004248088360237893 Morphology 0.013593882752761258 ONETEP 0.0016992353440951572 Polymorph 8.496176720475786E-4 QSAR 0.002548853016142736 Quantum Mechanics 0.4460492778249788 Reflex 0.038232795242141036 Reflex Plus 0.0 Semi-empirical 0.0033984706881903144 Sorption 0.03653355989804588 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.7782497875955819 X-Cell 0.0 ZDOCK 0.03993203058623619

Year

2023 0.0 2024 0.5061443932411674 2025 1.0 2026 0.1436251920122888

Keywords

development 1.0 target 0.943484521238301 potential 0.3624910007199424 docking 0.2476601871850252 novel 0.21022318214542837 analysis 0.17566594672426206 visualization 0.1353491720662347 promising 0.119150467962563 between 0.11087113030957524 binding 0.08459323254139668 activity 0.0665946724262059 effective 0.05363570914326854 design 0.04283657307415407 cell 0.04175665946724262 therapeutic 0.029517638588912886 protein 0.02771778257739381 including 0.020518358531317494 stability 0.01583873290136789 drug 0.014038876889848811 performance 0.01259899208063355 energy 0.010439164866810655 interaction 0.008639308855291577 compound 0.0025197984161267097 synthesized 0.0017998560115190785 mechanism 0.0
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