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Application

Discovery Studio 0.9020497447946204 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06774891774891775 Amorphous Cell 0.28344155844155844 Blends 0.0024891774891774893 CASTEP 0.39751082251082254 CDOCKER 0.15887445887445886 CHARMm 0.2446969696969697 COMPASS 0.3699134199134199 COMPASS III 0.08528138528138528 COSMObase 0.003787878787878788 COSMOconf 0.004004329004329004 COSMOmic 2.1645021645021645E-4 COSMOperm 0.0010822510822510823 COSMOplex 2.1645021645021645E-4 COSMOquick 0.0016233766233766235 COSMOtherm 0.0645021645021645 Cantera 0.0 Catalyst 0.10238095238095238 Classical Simulations 1.0 Conformers 9.74025974025974E-4 Crystallization 0.07532467532467532 DFTB Plus 0.004978354978354979 DMol3 0.1829004329004329 DPD 0.0024891774891774893 Discover 0.004112554112554113 Forcite 0.5417748917748918 GULP 0.026298701298701297 Kinetix 2.1645021645021645E-4 LUDI 0.0044372294372294376 LibDock 0.06666666666666667 LigandFit 0.005303030303030303 MCSS 9.74025974025974E-4 MODELER 0.19004329004329004 MesoDyn 0.0015151515151515152 Mesocite 0.004004329004329004 Mesoscale 0.007251082251082251 Modules 0.0 Morphology 0.017316017316017316 ONETEP 9.74025974025974E-4 Polymorph 0.001948051948051948 QMERA 2.1645021645021645E-4 QSAR 8.658008658008658E-4 Quantum Mechanics 0.5685064935064935 Reflex 0.05541125541125541 Reflex Plus 7.575757575757576E-4 Semi-empirical 0.007034632034632035 Sorption 0.057034632034632035 Synthia 0.0015151515151515152 TURBOMOLE 5.411255411255411E-4 VAMP 0.0016233766233766235 Visualization 0.7668831168831168 X-Cell 0.001406926406926407 ZDOCK 0.027813852813852815

Year

2021 0.03368553195940998 2022 0.17386755936813475 2023 0.22554660529344073 2024 0.7656658646301915 2025 1.0 2026 0.4445025630296056 2027 0.0

Keywords

target 1.0 potential 0.27036588320814153 docking 0.2013084565059365 analysis 0.18517082626605283 visualization 0.1844923673370487 between 0.15638478313544948 novel 0.09823116064938212 energy 0.09251272110491883 binding 0.06299975769323964 cell 0.062369760116307245 promising 0.05728131814877635 activity 0.042452144414829175 performance 0.035328325660285924 stability 0.03474678943542525 interaction 0.03271141264841289 experimental 0.031209110734189485 synthesized 0.02607220741458687 effective 0.020159922461836684 mechanism 0.019239156772473953 development 0.01768839350617882 including 0.013811485340440998 protein 0.01037072934334868 synthesis 0.007172280106614974 design 0.0035376787012357646 chemical 0.0
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