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Application

Discovery Studio 1.0 Materials Studio 0.6149439006922893 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.050265486725663715 Amorphous Cell 0.16460176991150444 Blends 0.003185840707964602 CASTEP 0.3054867256637168 CDOCKER 0.1713274336283186 CHARMm 0.26761061946902653 COMPASS 0.2591150442477876 COMPASS III 0.017699115044247787 COSMOconf 3.5398230088495576E-4 COSMOmic 0.0 COSMOperm 7.079646017699115E-4 COSMOplex 7.079646017699115E-4 COSMOquick 3.5398230088495576E-4 COSMOtherm 0.04743362831858407 Catalyst 0.18938053097345134 Classical Simulations 0.7465486725663717 Conformers 0.002831858407079646 Crystallization 0.05628318584070797 DFTB Plus 0.004247787610619469 DMol3 0.16 DPD 0.0021238938053097347 Discover 0.010265486725663717 Forcite 0.32672566371681416 GULP 0.02336283185840708 LUDI 0.006725663716814159 LibDock 0.07008849557522123 LigandFit 0.007787610619469027 MCSS 3.5398230088495576E-4 MODELER 0.07504424778761062 MesoDyn 0.003185840707964602 Mesocite 0.003185840707964602 Mesoscale 0.007433628318584071 Morphology 0.01663716814159292 ONETEP 0.001415929203539823 Polymorph 0.001415929203539823 QMERA 7.079646017699115E-4 QSAR 0.0010619469026548673 Quantum Mechanics 0.4527433628318584 Reflex 0.038584070796460174 Reflex Plus 0.0 Semi-empirical 0.007433628318584071 Sorption 0.03256637168141593 Synthia 3.5398230088495576E-4 TURBOMOLE 0.0 VAMP 0.0017699115044247787 Visualization 1.0 X-Cell 3.5398230088495576E-4 ZDOCK 0.02831858407079646

Year

2023 0.0

Keywords

target 1.0 visualization 0.3053193263298316 docking 0.2986493246623312 potential 0.23311655827913957 analysis 0.16074704018676006 between 0.12406203101550775 binding 0.09221277305319327 novel 0.08921127230281807 activity 0.07186926796731699 protein 0.05986326496581624 interaction 0.054527263631815905 energy 0.030515257628814407 synthesized 0.030015007503751877 cell 0.024178756044689012 drug 0.02051025512756378 compound 0.01967650491912623 silico 0.018509254627313655 synthesis 0.018509254627313655 vitro 0.01534100383525096 experimental 0.014840753710188427 mechanism 0.007337001834250459 promising 0.004502251125562781 chemical 0.002334500583625146 development 6.670001667500417E-4 well 0.0
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