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Application

Discovery Studio 1.0 Materials Studio 0.7520420070011669 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05802047781569966 Amorphous Cell 0.25369738339021614 Blends 0.0022753128555176336 CASTEP 0.2901023890784983 CDOCKER 0.20676905574516496 CHARMm 0.33248009101251425 COMPASS 0.30602957906712175 COMPASS III 0.1015358361774744 COSMObase 0.004550625711035267 COSMOconf 0.005972696245733789 COSMOmic 0.0 COSMOperm 5.688282138794084E-4 COSMOplex 2.844141069397042E-4 COSMOquick 8.532423208191126E-4 COSMOtherm 0.06399317406143344 Catalyst 0.09414106939704209 Classical Simulations 1.0 Conformers 5.688282138794084E-4 Crystallization 0.07110352673492605 DFTB Plus 0.003697383390216155 DMol3 0.13879408418657566 DPD 0.0031285551763367463 Discover 0.004550625711035267 Forcite 0.4786689419795222 GULP 0.015073947667804323 Kinetix 2.844141069397042E-4 LUDI 0.005119453924914676 LibDock 0.08503981797497157 LigandFit 0.00540386803185438 MCSS 2.844141069397042E-4 MODELER 0.3000568828213879 MesoDyn 5.688282138794084E-4 Mesocite 0.002559726962457338 Mesoscale 0.005972696245733789 Morphology 0.016496018202502846 ONETEP 0.0011376564277588168 Polymorph 0.0019908987485779293 QMERA 0.0 QSAR 5.688282138794084E-4 Quantum Mechanics 0.42235494880546076 Reflex 0.05091012514220705 Reflex Plus 5.688282138794084E-4 Semi-empirical 0.004835039817974972 Sorption 0.05204778156996587 Synthia 8.532423208191126E-4 TURBOMOLE 0.0 VAMP 5.688282138794084E-4 Visualization 0.800910125142207 X-Cell 0.001422070534698521 ZDOCK 0.0335608646188851

Year

2024 0.41596823996471105 2025 1.0 2026 0.7207763564181738 2027 0.0

Keywords

target 1.0 potential 0.3048019207683073 docking 0.24849939975990396 analysis 0.2112845138055222 visualization 0.17394957983193277 between 0.12352941176470589 novel 0.09423769507803122 binding 0.09303721488595439 promising 0.08787515006002401 activity 0.060984393757503 cell 0.04693877551020408 energy 0.04285714285714286 stability 0.0326530612244898 including 0.02629051620648259 development 0.019567827130852342 synthesized 0.01908763505402161 protein 0.018367346938775512 effective 0.016566626650660263 strong 0.014165666266506602 therapeutic 0.011884753901560624 performance 0.011404561824729893 mechanism 0.010684273709483794 synthesis 0.009243697478991597 interaction 0.007082833133253301 vitro 0.0
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