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Application

Discovery Studio 1.0 Materials Studio 0.012851897184822521 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0019880715705765406 Amorphous Cell 0.0044731610337972166 CASTEP 4.970178926441351E-4 CDOCKER 0.2117296222664016 CHARMm 0.2614314115308151 COMPASS 0.0064612326043737576 COMPASS III 0.0 COSMOconf 0.0 COSMOperm 0.0 COSMOtherm 0.002485089463220676 Catalyst 0.17296222664015903 Classical Simulations 0.2773359840954274 Conformers 0.0 Crystallization 9.940357852882703E-4 DFTB Plus 0.0 DMol3 0.0014910536779324055 Forcite 0.010934393638170975 LUDI 0.007952286282306162 LibDock 0.08449304174950298 LigandFit 0.010437375745526839 MCSS 0.0019880715705765406 MODELER 0.09642147117296222 MesoDyn 0.0 Mesoscale 0.0 QSAR 0.0 Quantum Mechanics 0.0019880715705765406 Reflex 9.940357852882703E-4 Semi-empirical 4.970178926441351E-4 Sorption 0.0 VAMP 0.0 Visualization 1.0 ZDOCK 0.04224652087475149

Year

2022 0.0

Keywords

target 1.0 visualization 0.5526506899055919 docking 0.5130718954248366 potential 0.3046477850399419 binding 0.2113289760348584 analysis 0.1804647785039942 activity 0.17610748002904866 protein 0.15976761074800291 novel 0.1514161220043573 vitro 0.10130718954248366 drug 0.09803921568627451 silico 0.09767610748002904 synthesis 0.08641975308641975 compound 0.07625272331154684 interaction 0.06935366739288308 inhibition 0.06753812636165578 treatment 0.06318082788671024 between 0.06281771968046478 synthesized 0.053013798111837325 potent 0.015250544662309368 development 0.010530137981118372 well 0.006172839506172839 design 0.0010893246187363835 cell 3.6310820624546115E-4 active 0.0
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