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Application

Discovery Studio 1.0 Materials Studio 0.9678145397254108 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05745212323064113 Amorphous Cell 0.2719955592561754 Blends 0.002497918401332223 CASTEP 0.31334998612267556 CDOCKER 0.17596447404940327 CHARMm 0.2778240355259506 COMPASS 0.3319456008881488 COMPASS III 0.10879822370247016 COSMObase 0.004995836802664446 COSMOconf 0.004718290313627533 COSMOmic 0.0 COSMOperm 5.550929780738274E-4 COSMOplex 2.775464890369137E-4 COSMOquick 5.550929780738274E-4 COSMOtherm 0.06355814598945324 Catalyst 0.07854565639744657 Classical Simulations 1.0 Conformers 5.550929780738274E-4 Crystallization 0.07327227310574522 DFTB Plus 0.0038856508465167916 DMol3 0.14321398834304747 DPD 0.002775464890369137 Discover 0.0038856508465167916 Forcite 0.5148487371634749 GULP 0.016930335831251735 Kinetix 2.775464890369137E-4 LUDI 0.0038856508465167916 LibDock 0.07188454066056064 LigandFit 0.004163197335553705 MODELER 0.25839578129336666 MesoDyn 0.0 Mesocite 0.0036081043574798777 Mesoscale 0.006106022758812101 Modules 0.0 Morphology 0.016097696364140993 ONETEP 0.0011101859561476548 Polymorph 0.002497918401332223 QMERA 2.775464890369137E-4 QSAR 0.0 Quantum Mechanics 0.44851512628365253 Reflex 0.05301137940605051 Reflex Plus 8.326394671107411E-4 Semi-empirical 0.004995836802664446 Sorption 0.057729669719678044 Synthia 0.0013877324451845685 TURBOMOLE 0.0 VAMP 2.775464890369137E-4 Visualization 0.7016375242853178 X-Cell 0.0013877324451845685 ZDOCK 0.028309741881765195

Year

2024 0.26518717776283346 2025 1.0 2026 0.8482403048643802 2027 0.0

Keywords

target 1.0 potential 0.3196448390677026 docking 0.23085460599334073 analysis 0.22905105438401777 visualization 0.16717536071032185 between 0.1391509433962264 promising 0.09253607103218646 novel 0.09128745837957825 binding 0.076165371809101 energy 0.06936736958934517 cell 0.0589622641509434 activity 0.05008324084350722 stability 0.0417591564927858 performance 0.037458379578246395 including 0.024972253052164262 strong 0.01997780244173141 synthesized 0.016648168701442843 effective 0.016370699223085462 development 0.014983351831298557 enhanced 0.013318534961154272 mechanism 0.009156492785793563 interaction 0.004855715871254162 experimental 0.004439511653718091 strategy 0.003329633740288568 protein 0.0
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