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Application

Discovery Studio 1.0 Materials Studio 0.9868767976989453 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06693008628336425 Amorphous Cell 0.278687202644948 Blends 0.0025804370615272964 CASTEP 0.40553181195064913 CDOCKER 0.17587291347471978 CHARMm 0.2591726473671478 COMPASS 0.3680348359003306 COMPASS III 0.07612289331505524 COSMObase 0.002983630352390936 COSMOconf 0.0034674623014273043 COSMOmic 1.6127731634545602E-4 COSMOperm 0.00120957987259092 COSMOplex 2.4191597451818402E-4 COSMOquick 0.00120957987259092 COSMOtherm 0.06322070800741876 Cantera 8.063865817272801E-5 Catalyst 0.12313523102975567 Classical Simulations 1.0 Conformers 0.001128941214418192 Crystallization 0.07475203612611886 DFTB Plus 0.006209176679300057 DMol3 0.18442061124102896 DPD 0.0029029916942182083 Discover 0.00443512619950004 Forcite 0.5332634464962503 GULP 0.026368841222482058 Kinetix 2.4191597451818402E-4 LUDI 0.0054027900975727764 LibDock 0.0711232965083461 LigandFit 0.007096201919200065 MCSS 0.0013708571889363762 MODELER 0.18756551890976533 MesoDyn 0.00161277316345456 Mesocite 0.0039512942504636725 Mesoscale 0.007499395210063704 Modules 0.0 Morphology 0.01782114345617289 ONETEP 8.870252399000081E-4 Polymorph 0.0018546891379727442 QMERA 2.4191597451818402E-4 QSAR 0.0012902185307636482 Quantum Mechanics 0.5782598177566325 Reflex 0.054673010241109585 Reflex Plus 7.257479235545521E-4 Semi-empirical 0.008305781791790985 Sorption 0.05418917829207322 Synthia 0.0014514958471091041 TURBOMOLE 5.64470607209096E-4 VAMP 0.001693411821627288 Visualization 0.8708168696072898 X-Cell 0.001128941214418192 ZDOCK 0.030158858156600275

Year

2020 0.020054295472458183 2021 0.13048428058498993 2022 0.2466065329713635 2023 0.441369647079429 2024 0.8977143357561959 2025 1.0 2026 0.37227427970925653 2027 0.0

Keywords

target 1.0 potential 0.2642394766585608 docking 0.2151933417816899 visualization 0.20998732746515053 analysis 0.18101174778230641 between 0.14943316094119258 novel 0.09918827276775011 energy 0.0814809740726787 binding 0.06850018837551804 cell 0.05805390964825153 activity 0.049902387231564885 promising 0.04469637291502552 interaction 0.03719560228790629 synthesized 0.027400075350207213 experimental 0.026954824125766347 stability 0.02616707195944789 protein 0.019077302462581772 performance 0.016611295681063124 mechanism 0.016234544644997774 effective 0.015618042949618112 development 0.015207041819365004 synthesis 0.011199780799397199 including 0.008802274206254066 chemical 0.0017467548035757098 design 0.0
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