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Application

Discovery Studio 1.0 Materials Studio 0.9113708820403825 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.056241426611796985 Amorphous Cell 0.2685871056241427 Blends 0.0021947873799725653 CASTEP 0.30507544581618656 CDOCKER 0.18244170096021947 CHARMm 0.2869684499314129 COMPASS 0.32729766803840876 COMPASS III 0.1102880658436214 COSMObase 0.0043895747599451305 COSMOconf 0.0054869684499314125 COSMOmic 0.0 COSMOperm 2.7434842249657066E-4 COSMOplex 2.7434842249657066E-4 COSMOquick 5.486968449931413E-4 COSMOtherm 0.06310013717421124 Catalyst 0.08422496570644719 Classical Simulations 1.0 Conformers 5.486968449931413E-4 Crystallization 0.07160493827160494 DFTB Plus 0.003840877914951989 DMol3 0.1421124828532236 DPD 0.0027434842249657062 Discover 0.0032921810699588477 Forcite 0.5097393689986283 GULP 0.01700960219478738 Kinetix 2.7434842249657066E-4 LUDI 0.0032921810699588477 LibDock 0.07462277091906722 LigandFit 0.00411522633744856 MODELER 0.2650205761316872 MesoDyn 0.0 Mesocite 0.0032921810699588477 Mesoscale 0.005761316872427984 Modules 0.0 Morphology 0.01646090534979424 ONETEP 0.0010973936899862826 Polymorph 0.0021947873799725653 QMERA 2.7434842249657066E-4 QSAR 0.0 Quantum Mechanics 0.43978052126200273 Reflex 0.051577503429355284 Reflex Plus 8.230452674897119E-4 Semi-empirical 0.005212620027434842 Sorption 0.0578875171467764 Synthia 0.0013717421124828531 TURBOMOLE 0.0 VAMP 5.486968449931413E-4 Visualization 0.7336076817558299 X-Cell 0.0013717421124828531 ZDOCK 0.0299039780521262

Year

2023 0.0 2024 0.33153347732181426 2025 1.0 2026 0.7663066954643628 2027 0.0021598272138228943

Keywords

target 1.0 potential 0.3154674823779758 docking 0.23912754355632398 analysis 0.22423194573746508 visualization 0.17475728155339806 between 0.1393802367336082 novel 0.09283149354967415 promising 0.08924059050405639 binding 0.07939885623088176 energy 0.06476925123021679 cell 0.05612448463891475 activity 0.05412953850246043 stability 0.03963292991089241 performance 0.03125415613778428 including 0.02487032850113047 development 0.017156536773507116 synthesized 0.015959569091634526 effective 0.014363612182471073 mechanism 0.013033648091501529 strong 0.012102673227822849 interaction 0.007846788136720309 enhanced 0.007314802500332491 protein 0.006117834818459901 experimental 0.005851842000265992 strategy 0.0
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