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Application

Discovery Studio 1.0 Materials Studio 0.9977644639184476 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06529527331561308 Amorphous Cell 0.2779382872992026 Blends 0.002542470819369005 CASTEP 0.3795215532185369 CDOCKER 0.16606957124696636 CHARMm 0.26337686351554374 COMPASS 0.3516699410609037 COMPASS III 0.08944874609961863 COSMObase 0.004044839939905235 COSMOconf 0.004622674217034555 COSMOmic 1.1556685542586386E-4 COSMOperm 0.0013868022651103663 COSMOplex 1.1556685542586386E-4 COSMOquick 0.0015023691205362302 COSMOtherm 0.06344620362879926 Cantera 0.0 Catalyst 0.11626025655841904 Classical Simulations 1.0 Conformers 6.934011325551831E-4 Crystallization 0.07061134866520281 DFTB Plus 0.005662775915867329 DMol3 0.1688431757771871 DPD 0.002542470819369005 Discover 0.0034670056627759157 Forcite 0.5333410377903617 GULP 0.02241996995261759 Kinetix 2.3113371085172773E-4 LUDI 0.004044839939905235 LibDock 0.0700335143880735 LigandFit 0.0048538079278862825 MCSS 5.778342771293193E-4 MODELER 0.2075580723448515 MesoDyn 9.245348434069109E-4 Mesocite 0.0031203050964983244 Mesoscale 0.006125043337570785 Modules 0.0 Morphology 0.016526060325898533 ONETEP 0.0011556685542586387 Polymorph 0.0019646365422396855 QMERA 1.1556685542586386E-4 QSAR 9.245348434069109E-4 Quantum Mechanics 0.5371547440194152 Reflex 0.05142725066450942 Reflex Plus 0.0010401016988327747 Semi-empirical 0.007165145036403559 Sorption 0.056743326014099156 Synthia 0.0012712354096845026 TURBOMOLE 4.6226742170345545E-4 VAMP 0.0011556685542586387 Visualization 0.8105859239570091 X-Cell 0.0015023691205362302 ZDOCK 0.0275049115913556

Year

2022 1.8034265103697024E-4 2023 0.2812443642921551 2024 0.4992786293958521 2025 1.0 2026 0.38322813345356177 2027 0.0

Keywords

target 1.0 potential 0.2930280421919218 docking 0.2257267815796244 analysis 0.2015950604579367 visualization 0.2005145356315925 between 0.15523540005145356 novel 0.10419346539747877 energy 0.08783123231283767 binding 0.07527656290198097 promising 0.06791870337020839 cell 0.06369951119114999 activity 0.0548494983277592 stability 0.03951633650630306 interaction 0.03431952662721893 performance 0.03277591973244147 synthesized 0.029688705942886546 experimental 0.027064574221764857 development 0.022279392847954722 effective 0.021198868021610497 including 0.020941600205814252 mechanism 0.020375611011062517 protein 0.018677643426807305 synthesis 0.011577051710830975 design 0.0038590172369436584 enhanced 0.0
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