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Application

Discovery Studio 0.7909116253136326 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06590205716366285 Amorphous Cell 0.2958310577098125 Blends 0.002184598580010923 CASTEP 0.3617331148734753 CDOCKER 0.1458219552157291 CHARMm 0.22829055161114145 COMPASS 0.3633715638084835 COMPASS III 0.10449663207718915 COSMObase 0.004915346805024577 COSMOconf 0.006189695976697615 COSMOmic 0.0 COSMOperm 9.102494083378846E-4 COSMOplex 1.820498816675769E-4 COSMOquick 0.0012743491716730383 COSMOtherm 0.070999453850355 Catalyst 0.07154560349535773 Classical Simulations 1.0 Conformers 3.640997633351538E-4 Crystallization 0.07318405243036592 DFTB Plus 0.004915346805024577 DMol3 0.1662115419624977 DPD 0.0023666484616785 Discover 0.004187147278354269 Forcite 0.5583469870744584 GULP 0.019115237575095576 Kinetix 1.820498816675769E-4 LUDI 0.0036409976333515383 LibDock 0.05971236118696523 LigandFit 0.0032768978700163844 MCSS 3.640997633351538E-4 MODELER 0.21900600764609504 MesoDyn 7.281995266703076E-4 Mesocite 0.0029127981066812306 Mesoscale 0.005643546331694884 Modules 0.0 Morphology 0.016930638995084655 ONETEP 9.102494083378846E-4 Polymorph 0.002002548698343346 QMERA 1.820498816675769E-4 QSAR 9.102494083378846E-4 Quantum Mechanics 0.5177498634625888 Reflex 0.0527944656835973 Reflex Plus 9.102494083378846E-4 Semi-empirical 0.006553795740032769 Sorption 0.05898416166029492 Synthia 0.0010922992900054614 TURBOMOLE 3.640997633351538E-4 VAMP 0.0010922992900054614 Visualization 0.6271618423448024 X-Cell 0.0016384489350081922 ZDOCK 0.025304933551793193

Year

2023 5.442917403728399E-4 2024 0.33446727445911006 2025 1.0 2026 0.5734113484827867 2027 0.0

Keywords

target 1.0 potential 0.2840268456375839 analysis 0.20116331096196868 docking 0.18174496644295302 between 0.15615212527964206 visualization 0.13995525727069352 energy 0.09619686800894854 novel 0.08966442953020134 promising 0.0766890380313199 cell 0.0708724832214765 performance 0.05646532438478747 binding 0.055391498881431765 stability 0.041073825503355706 activity 0.03534675615212528 experimental 0.026129753914988816 including 0.02237136465324385 synthesized 0.020313199105145414 effective 0.02022371364653244 enhanced 0.019149888143176735 development 0.014228187919463087 mechanism 0.01261744966442953 strong 0.011275167785234899 interaction 0.008859060402684563 design 0.00348993288590604 strategy 0.0
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