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Application

Discovery Studio 1.0 Materials Studio 0.8777530314278644 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05671930389945214 Amorphous Cell 0.26587173702868194 Blends 0.0019336126329358686 CASTEP 0.2955204640670319 CDOCKER 0.18143731872381566 CHARMm 0.29616500161134385 COMPASS 0.32839187882694165 COMPASS III 0.10312600708991299 COSMObase 0.0045117628101836935 COSMOconf 0.006123106670963584 COSMOmic 0.0 COSMOperm 6.445375443119562E-4 COSMOplex 3.222687721559781E-4 COSMOquick 6.445375443119562E-4 COSMOtherm 0.0602642603931679 Catalyst 0.07895584917821463 Classical Simulations 1.0 Conformers 3.222687721559781E-4 Crystallization 0.07251047373509507 DFTB Plus 0.0029004189494038026 DMol3 0.13728649693844666 DPD 0.0019336126329358686 Discover 0.0045117628101836935 Forcite 0.5056397035127296 GULP 0.014179825974863036 Kinetix 0.0 LUDI 0.004834031582339671 LibDock 0.07476635514018691 LigandFit 0.003544956493715759 MODELER 0.279407025459233 MesoDyn 0.0 Mesocite 0.003222687721559781 Mesoscale 0.00515630035449565 Morphology 0.01643570737995488 ONETEP 6.445375443119562E-4 Polymorph 0.002578150177247825 QMERA 3.222687721559781E-4 QSAR 3.222687721559781E-4 Quantum Mechanics 0.4253947792458911 Reflex 0.05220754108926845 Reflex Plus 6.445375443119562E-4 Semi-empirical 0.004189494038027715 Sorption 0.05671930389945214 Synthia 6.445375443119562E-4 TURBOMOLE 0.0 VAMP 3.222687721559781E-4 Visualization 0.7263938124395746 X-Cell 0.0016113438607798904 ZDOCK 0.031260070899129876

Year

2024 0.20116309807031457 2025 1.0 2026 0.9526830557758392 2027 0.0

Keywords

target 1.0 potential 0.3340983606557377 docking 0.25606557377049183 analysis 0.23721311475409837 visualization 0.179672131147541 between 0.13393442622950819 promising 0.0980327868852459 novel 0.09688524590163934 binding 0.09655737704918033 energy 0.05934426229508197 cell 0.058360655737704915 activity 0.05622950819672131 stability 0.04344262295081967 including 0.02721311475409836 strong 0.027049180327868853 performance 0.025737704918032785 effective 0.019672131147540985 development 0.015901639344262294 enhanced 0.010819672131147541 synthesized 0.010819672131147541 mechanism 0.008360655737704918 therapeutic 0.007377049180327869 protein 0.005245901639344262 interaction 0.003114754098360656 strategy 0.0
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