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Application

Discovery Studio 1.0 Materials Studio 0.15309038942479458 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.01455965909090909 Amorphous Cell 0.025923295454545456 Blends 0.0 CASTEP 0.09517045454545454 CDOCKER 0.3125 CHARMm 0.3838778409090909 COMPASS 0.04616477272727273 COMPASS III 0.013494318181818182 COSMObase 0.001065340909090909 COSMOconf 0.0014204545454545455 COSMOperm 3.551136363636364E-4 COSMOtherm 0.023082386363636364 Catalyst 0.2198153409090909 Classical Simulations 0.4861505681818182 Conformers 3.551136363636364E-4 Crystallization 0.02130681818181818 DFTB Plus 0.0 DMol3 0.11505681818181818 DPD 0.0 Discover 3.551136363636364E-4 Forcite 0.06782670454545454 GULP 0.0031960227272727275 LUDI 0.006392045454545455 LibDock 0.11505681818181818 LigandFit 0.01953125 MCSS 0.0017755681818181818 MODELER 0.34232954545454547 Mesocite 3.551136363636364E-4 Mesoscale 3.551136363636364E-4 Morphology 0.002130681818181818 ONETEP 3.551136363636364E-4 Polymorph 0.0 QMERA 3.551136363636364E-4 QSAR 3.551136363636364E-4 Quantum Mechanics 0.2059659090909091 Reflex 0.018821022727272728 Semi-empirical 0.001065340909090909 Sorption 0.0031960227272727275 VAMP 0.0 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03586647727272727

Year

2016 0.0 2017 0.08160621761658031 2018 0.12694300518134716 2019 0.13989637305699482 2020 0.16904145077720206 2021 0.22992227979274613 2022 0.33613989637305697 2023 0.46178756476683935 2024 1.0 2025 0.8465025906735751 2026 0.06411917098445596

Keywords

activity 1.0 target 0.9668408722292305 docking 0.4438637592358984 potential 0.3463687150837989 visualization 0.31014597224725177 analysis 0.1966120021625518 novel 0.1681384033159128 binding 0.14741394845918185 vitro 0.12218417732924851 compound 0.0967741935483871 inhibition 0.09515227969003424 synthesis 0.0892052622094071 synthesized 0.08325824472877996 protein 0.08091548026671472 promising 0.06649846819246712 between 0.06091187601369616 silico 0.05784826094791854 potent 0.049378266354298074 active 0.03874571994954046 treatment 0.029554874752207604 drug 0.022166156064155704 development 0.0185619030455938 enzyme 0.014056586772391421 interaction 0.007929356640836186 mechanism 0.0
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