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Application

Discovery Studio 0.8204295942720764 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06738853503184714 Amorphous Cell 0.2922292993630573 Blends 0.0022929936305732482 CASTEP 0.3866242038216561 CDOCKER 0.14229299363057324 CHARMm 0.23121019108280255 COMPASS 0.3676433121019108 COMPASS III 0.09414012738853503 COSMObase 0.003949044585987261 COSMOconf 0.00535031847133758 COSMOmic 1.2738853503184712E-4 COSMOperm 0.0012738853503184713 COSMOplex 2.5477707006369424E-4 COSMOquick 0.0015286624203821656 COSMOtherm 0.06764331210191082 Cantera 0.0 Catalyst 0.0867515923566879 Classical Simulations 1.0 Conformers 5.095541401273885E-4 Crystallization 0.07363057324840765 DFTB Plus 0.005859872611464968 DMol3 0.17235668789808917 DPD 0.0025477707006369425 Discover 0.0035668789808917197 Forcite 0.5577070063694267 GULP 0.02165605095541401 Kinetix 2.5477707006369424E-4 LUDI 0.003057324840764331 LibDock 0.061528662420382164 LigandFit 0.0035668789808917197 MCSS 5.095541401273885E-4 MODELER 0.20828025477707007 MesoDyn 7.643312101910828E-4 Mesocite 0.003057324840764331 Mesoscale 0.005987261146496815 Modules 0.0 Morphology 0.01732484076433121 ONETEP 0.0011464968152866241 Polymorph 0.002038216560509554 QMERA 1.2738853503184712E-4 QSAR 8.917197452229299E-4 Quantum Mechanics 0.5478980891719745 Reflex 0.05312101910828025 Reflex Plus 0.0011464968152866241 Semi-empirical 0.007261146496815286 Sorption 0.05910828025477707 Synthia 0.0015286624203821656 TURBOMOLE 6.369426751592356E-4 VAMP 0.001019108280254777 Visualization 0.687515923566879 X-Cell 0.0015286624203821656 ZDOCK 0.024840764331210193

Year

2023 0.09328500572300649 2024 0.47396032048836323 2025 1.0 2026 0.4053796260969096 2027 0.0

Keywords

target 1.0 potential 0.28351254480286736 analysis 0.19767025089605736 docking 0.19008363201911588 between 0.16344086021505377 visualization 0.1627837514934289 energy 0.10209080047789726 novel 0.09725209080047789 promising 0.07389486260454002 cell 0.07186379928315412 binding 0.05967741935483871 performance 0.04886499402628435 stability 0.044563918757467146 activity 0.04115890083632019 experimental 0.03387096774193549 synthesized 0.025686977299880526 interaction 0.025268817204301075 including 0.023775388291517322 effective 0.022879330943847073 mechanism 0.022162485065710873 development 0.01971326164874552 enhanced 0.012962962962962963 design 0.004241338112305855 synthesis 0.002688172043010753 protein 0.0
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