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Application

Discovery Studio 0.4369918699186992 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.11965065502183406 Amorphous Cell 0.34934497816593885 Blends 0.0017467248908296944 CASTEP 0.38427947598253276 CDOCKER 0.05327510917030567 CHARMm 0.1388646288209607 COMPASS 0.4427947598253275 COMPASS III 0.11615720524017467 COSMObase 0.010480349344978166 COSMOconf 0.017467248908296942 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.0034934497816593887 COSMOtherm 0.1240174672489083 Catalyst 0.039301310043668124 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.05589519650655022 DFTB Plus 0.004366812227074236 DMol3 0.15109170305676856 DPD 0.0034934497816593887 Discover 0.004366812227074236 Forcite 0.6157205240174672 GULP 0.029694323144104803 LUDI 0.0 LibDock 0.02096069868995633 LigandFit 8.733624454148472E-4 MODELER 0.09606986899563319 MesoDyn 8.733624454148472E-4 Mesocite 0.0017467248908296944 Mesoscale 0.0069868995633187774 Morphology 0.017467248908296942 Polymorph 0.0 QSAR 0.0 Quantum Mechanics 0.5205240174672489 Reflex 0.03668122270742358 Semi-empirical 0.005240174672489083 Sorption 0.0462882096069869 Synthia 8.733624454148472E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.44454148471615723 X-Cell 0.0017467248908296944 ZDOCK 0.01572052401746725

Year

2023 0.020226537216828478 2024 0.35032362459546923 2025 1.0 2026 0.6885113268608414 2027 0.0

Keywords

experimental 1.0 target 0.903625516291877 potential 0.21248279027076641 analysis 0.200550711335475 between 0.19871500688389168 energy 0.1234511243689766 docking 0.10325837540156035 performance 0.08444240477283158 cell 0.08260670032124828 visualization 0.06470858191831115 novel 0.043139054612207434 including 0.03533731069297843 stability 0.029830197338228545 synthesized 0.029371271225332722 promising 0.0289123451124369 chemical 0.02661771454795778 interaction 0.023405231757687012 amorphous 0.02065167508031207 mechanism 0.010555300596603947 effective 0.009637448370812299 binding 0.005966039467645709 strong 0.005507113354749885 enhanced 0.005048187241854061 adsorption 4.589261128958238E-4 surface 0.0
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