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Application

Discovery Studio 0.9931703810208483 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05854084753167322 Amorphous Cell 0.2793796417649629 Blends 0.002402795980777632 CASTEP 0.3274355613805155 CDOCKER 0.17016164263870687 CHARMm 0.2704237658366099 COMPASS 0.3396679772826562 COMPASS III 0.10506771515945827 COSMObase 0.004805591961555264 COSMOconf 0.005897771952817824 COSMOmic 0.0 COSMOperm 4.3687199650502403E-4 COSMOplex 2.1843599825251202E-4 COSMOquick 6.55307994757536E-4 COSMOtherm 0.06487549148099607 Catalyst 0.07972913936216688 Classical Simulations 1.0 Conformers 4.3687199650502403E-4 Crystallization 0.07295762341633902 DFTB Plus 0.004150283966797728 DMol3 0.1505024027959808 DPD 0.002402795980777632 Discover 0.00436871996505024 Forcite 0.5246832678025338 GULP 0.01747487986020096 Kinetix 2.1843599825251202E-4 LUDI 0.003931847968545216 LibDock 0.07033639143730887 LigandFit 0.003931847968545216 MCSS 0.0 MODELER 0.25054608999563127 MesoDyn 6.55307994757536E-4 Mesocite 0.0030581039755351682 Mesoscale 0.005897771952817824 Modules 0.0 Morphology 0.016601135867190912 ONETEP 8.737439930100481E-4 Polymorph 0.002402795980777632 QMERA 2.1843599825251202E-4 QSAR 4.3687199650502403E-4 Quantum Mechanics 0.4694189602446483 Reflex 0.0526430755788554 Reflex Plus 8.737439930100481E-4 Semi-empirical 0.005679335954565312 Sorption 0.05744866754041066 Synthia 0.00109217999126256 TURBOMOLE 2.1843599825251202E-4 VAMP 8.737439930100481E-4 Visualization 0.6935342944517257 X-Cell 0.001310615989515072 ZDOCK 0.027959807776321538

Year

2023 0.0 2024 0.3933674369377315 2025 1.0 2026 0.7235844064208855 2027 0.0010583877227024166

Keywords

target 1.0 potential 0.30430611809848646 docking 0.2225538264762311 analysis 0.21892986570027712 visualization 0.16265188659134514 between 0.1460243018546152 novel 0.09379663184822 promising 0.08857386484758048 energy 0.07599658921338734 binding 0.07439778298870177 cell 0.0634193135791942 activity 0.04903005755702409 stability 0.04295459390321893 performance 0.04092943935195054 including 0.022170112982306544 effective 0.017480281389895543 development 0.016520997655084205 synthesized 0.0164144105734385 mechanism 0.015241952675335749 experimental 0.013962907695587294 enhanced 0.013003623960775954 strong 0.010871882327861864 interaction 0.008100618205073545 protein 6.395224898742272E-4 design 0.0
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