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Application

Discovery Studio 0.8473978241693619 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06706447009988326 Amorphous Cell 0.28979115319756127 Blends 0.0020754961733039303 CASTEP 0.38370735503956416 CDOCKER 0.14736022830457907 CHARMm 0.23647684524581658 COMPASS 0.3650278894798288 COMPASS III 0.09378648333117136 COSMObase 0.003761836814113374 COSMOconf 0.0053184589440913215 COSMOmic 1.2971851083149564E-4 COSMOperm 9.080295758204696E-4 COSMOplex 2.594370216629913E-4 COSMOquick 0.0014269036191464522 COSMOtherm 0.06745362563237774 Cantera 0.0 Catalyst 0.09132183162537294 Classical Simulations 1.0 Conformers 3.8915553249448695E-4 Crystallization 0.07445842521727851 DFTB Plus 0.006096770009080296 DMol3 0.17070956025424827 DPD 0.0024646517057984175 Discover 0.003502399792450383 Forcite 0.5515631080555196 GULP 0.021144117265533793 Kinetix 2.594370216629913E-4 LUDI 0.0032429627707873912 LibDock 0.0626540407316124 LigandFit 0.003372681281618887 MCSS 5.188740433259826E-4 MODELER 0.20832792839538203 MesoDyn 7.783110649889739E-4 Mesocite 0.0029835257491244 Mesoscale 0.005707614476585809 Modules 0.0 Morphology 0.01764171747308341 ONETEP 0.001167466597483461 Polymorph 0.0020754961733039303 QMERA 1.2971851083149564E-4 QSAR 0.0010377480866519651 Quantum Mechanics 0.5440394344272927 Reflex 0.053703463484239204 Reflex Plus 0.0010377480866519651 Semi-empirical 0.007523673628226748 Sorption 0.057854455830847064 Synthia 0.0012971851083149566 TURBOMOLE 5.188740433259826E-4 VAMP 0.0010377480866519651 Visualization 0.7017771435983915 X-Cell 0.0014269036191464522 ZDOCK 0.025295109612141653

Year

2023 0.11722895184703173 2024 0.5021523676043648 2025 1.0 2026 0.42536790469516467 2027 0.0

Keywords

target 1.0 potential 0.28183526274319654 analysis 0.19583005030607917 docking 0.19261773440814595 visualization 0.16394933026244016 between 0.1591005515485787 energy 0.09570276986484029 novel 0.09467240438814474 promising 0.07024668161706771 cell 0.06545851263712953 binding 0.05897327110733984 performance 0.04448754469967877 stability 0.04079035093035942 activity 0.04030547305897327 experimental 0.0286684041457058 synthesized 0.02272865022122553 interaction 0.021880113946299774 including 0.01957694405721559 effective 0.018667798048366567 mechanism 0.017879871507364083 development 0.01539487241651009 enhanced 0.007939875143948118 design 9.091460088490211E-4 synthesis 6.667070731559489E-4 protein 0.0
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