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Application

Discovery Studio 1.0 Materials Studio 0.7592319054652881 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.049663299663299666 Amorphous Cell 0.2596801346801347 Blends 8.417508417508417E-4 CASTEP 0.26557239057239057 CDOCKER 0.2032828282828283 CHARMm 0.3228114478114478 COMPASS 0.3106060606060606 COMPASS III 0.10942760942760943 COSMObase 0.004208754208754209 COSMOconf 0.006734006734006734 COSMOmic 0.0 COSMOperm 4.2087542087542086E-4 COSMOplex 4.2087542087542086E-4 COSMOquick 4.2087542087542086E-4 COSMOtherm 0.05765993265993266 Catalyst 0.08754208754208755 Classical Simulations 1.0 Conformers 4.2087542087542086E-4 Crystallization 0.07196969696969698 DFTB Plus 0.003787878787878788 DMol3 0.12205387205387205 DPD 0.0021043771043771043 Discover 0.004208754208754209 Forcite 0.48653198653198654 GULP 0.012205387205387205 Kinetix 0.0 LUDI 0.003367003367003367 LibDock 0.08080808080808081 LigandFit 0.004629629629629629 MODELER 0.29292929292929293 Mesocite 0.003367003367003367 Mesoscale 0.005050505050505051 Morphology 0.016414141414141416 ONETEP 8.417508417508417E-4 Polymorph 0.0025252525252525255 QMERA 0.0 Quantum Mechanics 0.38257575757575757 Reflex 0.05134680134680135 Reflex Plus 8.417508417508417E-4 Semi-empirical 0.004629629629629629 Sorption 0.06018518518518518 Synthia 8.417508417508417E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7866161616161617 X-Cell 8.417508417508417E-4 ZDOCK 0.03282828282828283

Year

2024 0.11863887185775598 2025 1.0 2026 0.8298589822194973 2027 0.0

Keywords

target 1.0 potential 0.34339466611536074 docking 0.2731031631176349 analysis 0.24126524705395908 visualization 0.19681620839363242 between 0.12569774653710977 binding 0.09654744676452347 promising 0.09592722762042588 novel 0.09385983047343395 activity 0.06326235269795327 cell 0.05147818896009924 energy 0.04961753152780649 stability 0.03514575149886293 including 0.03204465577837502 strong 0.024188546619805663 therapeutic 0.017366136034732273 development 0.014678519743642754 synthesized 0.014058300599545173 effective 0.012817862311350011 protein 0.012611122596650816 performance 0.011577424023154847 mechanism 0.006822410585073393 interaction 0.0026876162910895183 strategy 4.134794293983874E-4 synthesis 0.0
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