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Application

Discovery Studio 0.3463481855764814 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06132155597078308 Amorphous Cell 0.27280448445727873 Blends 0.0023781212841854932 CASTEP 0.017156446407338204 CDOCKER 0.07728894173602854 CHARMm 0.2581960251401393 COMPASS 0.35688805843383725 COMPASS III 0.08850008493290301 COSMOconf 1.6986580601324953E-4 COSMOperm 5.095974180397486E-4 COSMOplex 0.0 COSMOtherm 0.0020383896721589945 Catalyst 0.02497027348394768 Classical Simulations 1.0 Conformers 5.095974180397486E-4 Crystallization 0.0377102089349414 DFTB Plus 0.0033973161202649907 DMol3 0.03431289281467641 DPD 0.0011890606420927466 Discover 0.002887718702225242 Forcite 0.5315101070154578 GULP 0.022762018005775438 Kinetix 0.0 LUDI 0.0016986580601324954 LibDock 0.023271615423815187 LigandFit 0.0030575845082384916 MODELER 0.0360115508748089 MesoDyn 1.6986580601324953E-4 Mesocite 0.0015287922541192458 Mesoscale 0.002887718702225242 Modules 0.0 Morphology 0.01732631221335145 Polymorph 0.0023781212841854932 QMERA 1.6986580601324953E-4 Quantum Mechanics 0.04858162051978936 Reflex 0.017666043825377953 Reflex Plus 3.3973161202649905E-4 Semi-empirical 0.0049261083743842365 Sorption 0.060472226940716835 Synthia 0.0015287922541192458 TURBOMOLE 0.0 VAMP 0.0010191948360794973 ZDOCK 0.007643961270596229

Year

2022 0.008998875140607425 2023 0.11998500187476566 2024 0.3775778027746532 2025 1.0 2026 0.6876640419947506 2027 0.0

Keywords

target 1.0 cell 0.23253298723772442 between 0.19922128487994809 amorphous 0.17953709712308025 potential 0.1691542288557214 energy 0.1399524118537746 performance 0.12848799480856588 analysis 0.1118321436296777 experimental 0.05948518278174346 novel 0.05537529742591391 adsorption 0.04737183646982479 enhanced 0.04261302184728531 mechanism 0.04023361453601557 surface 0.03439325113562622 interaction 0.03223015357992645 docking 0.0317975340687865 promising 0.027471338957386977 stability 0.02509193164611724 strategy 0.020765736534717714 effective 0.017953709712308027 development 0.01189703655634869 design 0.008436080467229072 efficient 0.004975124378109453 water 0.0025957170668397143 higher 0.0
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