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Application

Discovery Studio 0.8154883530854107 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06300233341975629 Amorphous Cell 0.2960850401866736 Blends 0.002074150894477573 CASTEP 0.33808659579984446 CDOCKER 0.1477832512315271 CHARMm 0.23645320197044334 COMPASS 0.35105003889032926 COMPASS III 0.11252268602540835 COSMObase 0.0054446460980036296 COSMOconf 0.0059631838216230235 COSMOmic 0.0 COSMOperm 5.185377236193933E-4 COSMOplex 2.5926886180969663E-4 COSMOquick 0.0010370754472387865 COSMOtherm 0.06870624837956961 Catalyst 0.06740990407052114 Classical Simulations 1.0 Conformers 5.185377236193933E-4 Crystallization 0.07648431423386051 DFTB Plus 0.0033704952035260565 DMol3 0.15919108115115374 DPD 0.0025926886180969665 Discover 0.005185377236193933 Forcite 0.5506870624837957 GULP 0.018408089188488463 Kinetix 2.5926886180969663E-4 LUDI 0.00388903292714545 LibDock 0.06015037593984962 LigandFit 0.002851957479906663 MODELER 0.2253046409126264 MesoDyn 7.7780658542909E-4 Mesocite 0.003629764065335753 Mesoscale 0.006740990407052113 Morphology 0.017630282603059374 ONETEP 0.0010370754472387865 Polymorph 0.00233341975628727 QMERA 2.5926886180969663E-4 QSAR 7.7780658542909E-4 Quantum Mechanics 0.4879439979258491 Reflex 0.05522426756546539 Reflex Plus 5.185377236193933E-4 Semi-empirical 0.0049261083743842365 Sorption 0.05963183821623023 Synthia 0.0012963443090484833 TURBOMOLE 0.0 VAMP 7.7780658542909E-4 Visualization 0.6155042779362199 X-Cell 0.00155561317085818 ZDOCK 0.02411200414830179

Year

2024 0.16332022355619955 2025 1.0 2026 0.8412336990271165 2027 0.0

Keywords

target 1.0 potential 0.29485452586206895 analysis 0.21322737068965517 docking 0.18844288793103448 between 0.14695581896551724 visualization 0.13968211206896552 energy 0.09307650862068965 promising 0.08917025862068965 novel 0.08216594827586207 cell 0.07112068965517242 performance 0.05994073275862069 binding 0.05980603448275862 stability 0.04849137931034483 activity 0.0334051724137931 enhanced 0.024110991379310345 including 0.023706896551724137 strong 0.02330280172413793 experimental 0.01993534482758621 effective 0.015220905172413793 mechanism 0.011045258620689655 development 0.010371767241379311 synthesized 0.009563577586206896 strategy 0.009428879310344827 design 0.00390625 interaction 0.0
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