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Application

Discovery Studio 1.0 Materials Studio 0.8848114169215087 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05852485301977552 Amorphous Cell 0.26830571886691607 Blends 0.0018706574024585784 CASTEP 0.30464991982896844 CDOCKER 0.1811865312667023 CHARMm 0.2942276857295564 COMPASS 0.32923570283270975 COMPASS III 0.10261892036344201 COSMObase 0.005344735435595938 COSMOconf 0.005879208979155532 COSMOmic 0.0 COSMOperm 5.344735435595938E-4 COSMOplex 2.672367717797969E-4 COSMOquick 0.0010689470871191875 COSMOtherm 0.06146445750935329 Catalyst 0.08364510956707644 Classical Simulations 1.0 Conformers 2.672367717797969E-4 Crystallization 0.07001603420630678 DFTB Plus 0.002672367717797969 DMol3 0.14377338321753072 DPD 0.0018706574024585784 Discover 0.005077498663816141 Forcite 0.5085515766969535 GULP 0.01549973276322822 Kinetix 0.0 LUDI 0.004543025120256547 LibDock 0.07536076964190272 LigandFit 0.00427578834847675 MCSS 2.672367717797969E-4 MODELER 0.2773917691074292 MesoDyn 5.344735435595938E-4 Mesocite 0.003206841261357563 Mesoscale 0.005344735435595938 Morphology 0.016034206306787813 ONETEP 8.017103153393907E-4 Polymorph 0.002137894174238375 QMERA 2.672367717797969E-4 QSAR 2.672367717797969E-4 Quantum Mechanics 0.4401389631213255 Reflex 0.050774986638161414 Reflex Plus 5.344735435595938E-4 Semi-empirical 0.00427578834847675 Sorption 0.05424906467129877 Synthia 5.344735435595938E-4 TURBOMOLE 0.0 VAMP 8.017103153393907E-4 Visualization 0.7340994120791021 X-Cell 0.0013361838588989846 ZDOCK 0.030732228754676644

Year

2024 0.35029266096352996 2025 1.0 2026 0.8874380909500225 2027 0.0

Keywords

target 1.0 potential 0.3237807282765873 docking 0.24819245431839096 analysis 0.23097147364269752 visualization 0.1757591691862758 between 0.14013408702510846 novel 0.09425529117917707 promising 0.09359800184041014 binding 0.0868936505849875 energy 0.061653739976337586 cell 0.05692125673721572 activity 0.05218877349809386 stability 0.03785986591297489 including 0.024976994873143157 performance 0.022742211121335613 strong 0.01695806494018667 development 0.014328907585118969 synthesized 0.013408702510845274 effective 0.01327724464309189 mechanism 0.008939135007230183 protein 0.006572893387669252 enhanced 0.004732483239121861 interaction 0.003812278164848166 therapeutic 0.0010516629420270803 experimental 0.0
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