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Application

Discovery Studio 1.0 Materials Studio 0.29500580720092917 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.027149321266968326 Amorphous Cell 0.10135746606334842 Blends 0.0018099547511312218 CASTEP 0.14570135746606336 CDOCKER 0.18642533936651584 CHARMm 0.23529411764705882 COMPASS 0.14751131221719457 COMPASS III 0.0027149321266968325 COSMOconf 0.0 COSMOtherm 0.02171945701357466 Catalyst 0.17104072398190046 Classical Simulations 0.5013574660633484 Crystallization 0.023529411764705882 DFTB Plus 9.049773755656109E-4 DMol3 0.05972850678733032 DPD 0.0036199095022624436 Discover 0.006334841628959276 Forcite 0.17647058823529413 GULP 0.009954751131221719 LUDI 0.008144796380090498 LibDock 0.07782805429864253 LigandFit 0.006334841628959276 MCSS 0.0027149321266968325 MODELER 0.1076923076923077 Mesocite 0.004524886877828055 Mesoscale 0.005429864253393665 Morphology 0.004524886877828055 ONETEP 0.0 QSAR 9.049773755656109E-4 Quantum Mechanics 0.20180995475113123 Reflex 0.01809954751131222 Semi-empirical 9.049773755656109E-4 Sorption 0.009954751131221719 TURBOMOLE 0.0 Visualization 1.0 ZDOCK 0.04253393665158371

Year

2022 0.0

Keywords

target 1.0 visualization 0.4027921406411582 docking 0.37435367114788004 potential 0.22130299896587383 binding 0.13340227507755947 analysis 0.1313340227507756 activity 0.11427094105480869 between 0.10496380558428128 protein 0.10392967942088935 novel 0.10289555325749741 interaction 0.0594622543950362 synthesis 0.05739400206825233 silico 0.05377456049638056 compound 0.047569803516028956 vitro 0.04343329886246122 synthesized 0.03981385729058945 drug 0.03722854188210962 cell 0.025336091003102378 inhibition 0.021199586349534644 treatment 0.014477766287487074 development 0.008790072388831437 mechanism 0.005687693898655636 design 0.004653567735263702 active 0.001034126163391934 well 0.0
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