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Application

Discovery Studio 0.8870578207131695 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06924177396280401 Amorphous Cell 0.28412017167381975 Blends 0.002575107296137339 CASTEP 0.3986647591797806 CDOCKER 0.1530758226037196 CHARMm 0.24034334763948498 COMPASS 0.37234144015259896 COMPASS III 0.08326180257510729 COSMObase 0.0035288507391511683 COSMOconf 0.004101096804959466 COSMOmic 1.9074868860276584E-4 COSMOperm 0.001335240820219361 COSMOplex 2.861230329041488E-4 COSMOquick 0.0015259895088221267 COSMOtherm 0.06437768240343347 Cantera 0.0 Catalyst 0.11235097758702908 Classical Simulations 1.0 Conformers 9.537434430138292E-4 Crystallization 0.07715784453981879 DFTB Plus 0.005627086313781593 DMol3 0.18149737720553172 DPD 0.002765855984740105 Discover 0.003814973772055317 Forcite 0.5471626132570339 GULP 0.025560324272770624 Kinetix 2.861230329041488E-4 LUDI 0.004101096804959466 LibDock 0.06523605150214593 LigandFit 0.004959465903671912 MCSS 6.676204101096805E-4 MODELER 0.17749165474487363 MesoDyn 0.0015259895088221267 Mesocite 0.004005722460658083 Mesoscale 0.007439198855507869 Modules 0.0 Morphology 0.018025751072961373 ONETEP 0.0010491177873152122 Polymorph 0.0020028612303290413 QMERA 1.9074868860276584E-4 QSAR 9.537434430138292E-4 Quantum Mechanics 0.5684310920362422 Reflex 0.056556986170720074 Reflex Plus 8.583690987124463E-4 Semi-empirical 0.007534573199809251 Sorption 0.057033857892226994 Synthia 0.0016213638531235098 TURBOMOLE 5.722460658082976E-4 VAMP 0.0015259895088221267 Visualization 0.7683357176919409 X-Cell 0.001239866475917978 ZDOCK 0.02632331902718169

Year

2022 0.05749144211357851 2023 0.34126217853067675 2024 0.7389625208461336 2025 1.0 2026 0.37312384797682785 2027 0.0

Keywords

target 1.0 potential 0.27426935566569816 docking 0.20223038796786874 analysis 0.1879165954537686 visualization 0.18667749102717485 between 0.15804990599897453 novel 0.09900017091095539 energy 0.0954537685865664 cell 0.06473252435481114 binding 0.06374978636130577 promising 0.057212442317552556 activity 0.04537685865663989 stability 0.0374294992309007 performance 0.035592206460434116 interaction 0.03499401811656127 experimental 0.03328490856263887 synthesized 0.02875576824474449 effective 0.02127841394633396 mechanism 0.020082037258588276 development 0.01897111604853871 including 0.017860194838489146 protein 0.011493761750128183 synthesis 0.009143736113484874 design 0.002392753375491369 chemical 0.0
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