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Application

Discovery Studio 0.9352051835853131 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06358099878197321 Amorphous Cell 0.2869671132764921 Blends 0.002192448233861145 CASTEP 0.3320341047503045 CDOCKER 0.16345919610231424 CHARMm 0.25115712545676006 COMPASS 0.34884287454324 COMPASS III 0.10426309378806334 COSMObase 0.00438489646772229 COSMOconf 0.006577344701583435 COSMOmic 0.0 COSMOperm 4.8721071863581E-4 COSMOplex 2.43605359317905E-4 COSMOquick 7.30816077953715E-4 COSMOtherm 0.06894031668696711 Catalyst 0.08331303288672351 Classical Simulations 1.0 Conformers 4.8721071863581E-4 Crystallization 0.0733252131546894 DFTB Plus 0.00438489646772229 DMol3 0.151278928136419 DPD 0.00194884287454324 Discover 0.00341047503045067 Forcite 0.5417783191230207 GULP 0.016321559074299635 Kinetix 2.43605359317905E-4 LUDI 0.0036540803897685747 LibDock 0.06528623629719854 LigandFit 0.00389768574908648 MCSS 4.8721071863581E-4 MODELER 0.2392204628501827 MesoDyn 0.0 Mesocite 0.003166869671132765 Mesoscale 0.005115712545676005 Morphology 0.01705237515225335 ONETEP 0.001218026796589525 Polymorph 0.001705237515225335 QMERA 2.43605359317905E-4 QSAR 2.43605359317905E-4 Quantum Mechanics 0.4762484774665043 Reflex 0.052862362971985384 Reflex Plus 2.43605359317905E-4 Semi-empirical 0.0060901339829476245 Sorption 0.05773447015834348 Synthia 9.7442143727162E-4 TURBOMOLE 4.8721071863581E-4 VAMP 9.7442143727162E-4 Visualization 0.6835566382460414 X-Cell 0.00194884287454324 ZDOCK 0.02825822168087698

Year

2023 7.616146230007616E-4 2024 0.3591012947448591 2025 1.0 2026 0.6768849961919269 2027 0.0

Keywords

target 1.0 potential 0.29800778026641517 analysis 0.20959566191205942 docking 0.20900624778969704 visualization 0.1580808676175881 between 0.14476010845219853 novel 0.09088765766827774 energy 0.07968878934339267 promising 0.0776847813273606 binding 0.06471767063538843 cell 0.06330307674171873 performance 0.04585641871979253 activity 0.04538488742190263 stability 0.037604621006719324 including 0.02133679122951786 synthesized 0.01945066603795827 experimental 0.01756454084639868 effective 0.01567841565483909 mechanism 0.01567841565483909 development 0.014617470234586821 enhanced 0.0137922904632795 strong 0.010373688553577743 interaction 0.0048331958033714486 strategy 2.3576564894494873E-4 design 0.0
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