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Application

Discovery Studio 1.0 Materials Studio 0.37487636003956476 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.031366294524189264 Amorphous Cell 0.0861244019138756 Blends 0.002658160552897395 CASTEP 0.22062732589048378 CDOCKER 0.2174375332270069 CHARMm 0.25890483785220625 COMPASS 0.15576820839978733 COMPASS III 5.31632110579479E-4 COSMOmic 0.0 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.03083466241360978 Catalyst 0.07496012759170653 Classical Simulations 0.5555555555555556 Conformers 0.0 Crystallization 0.029239766081871343 DFTB Plus 0.002126528442317916 DMol3 0.10685805422647528 DPD 0.004253056884635832 Discover 0.007974481658692184 Forcite 0.17118553960659225 GULP 0.025518341307814992 LUDI 0.009569377990430622 LibDock 0.07389686337054759 LigandFit 0.017543859649122806 MCSS 0.004784688995215311 MODELER 0.28761297182349815 MesoDyn 5.31632110579479E-4 Mesocite 0.00531632110579479 Mesoscale 0.007442849548112706 Morphology 0.007974481658692184 ONETEP 5.31632110579479E-4 Polymorph 0.001594896331738437 QMERA 0.001063264221158958 QSAR 0.001594896331738437 Quantum Mechanics 0.31791600212652843 Reflex 0.017543859649122806 Reflex Plus 0.001063264221158958 Semi-empirical 0.005847953216374269 Sorption 0.01594896331738437 Synthia 5.31632110579479E-4 VAMP 0.001594896331738437 Visualization 1.0 ZDOCK 0.03561935140882509

Year

2021 0.0

Keywords

target 1.0 visualization 0.348761230601688 docking 0.314184590253199 potential 0.22597331881295943 analysis 0.1570922951265995 between 0.12251565477811054 binding 0.11434794445956983 novel 0.11353117342771576 activity 0.09746800980125238 protein 0.07704873400490063 interaction 0.04955077593248026 drug 0.048189490879390146 compound 0.02885924312551048 well 0.02804247209365641 synthesis 0.023414102913150013 inhibition 0.021780560849441872 synthesized 0.021780560849441872 vitro 0.021236046828205825 silico 0.01905799074326164 treatment 0.013068336509665124 cell 0.00871222433977675 development 0.007895453307922679 experimental 0.0057173972229784915 mechanism 0.0021780560849441874 active 0.0
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