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Application

Discovery Studio 0.9190566037735849 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057913247362250876 Amorphous Cell 0.2818288393903869 Blends 0.0018757327080890973 CASTEP 0.3343493552168816 CDOCKER 0.15685814771395076 CHARMm 0.25580304806565063 COMPASS 0.3516998827667057 COMPASS III 0.1041031652989449 COSMObase 0.004220398593200469 COSMOconf 0.005158264947245018 COSMOmic 2.3446658851113716E-4 COSMOperm 4.689331770222743E-4 COSMOplex 2.3446658851113716E-4 COSMOquick 0.001406799531066823 COSMOtherm 0.0611957796014068 Catalyst 0.07549824150058616 Classical Simulations 1.0 Conformers 2.3446658851113716E-4 Crystallization 0.07174677608440796 DFTB Plus 0.0037514654161781946 DMol3 0.15146541617819462 DPD 0.0018757327080890973 Discover 0.0035169988276670576 Forcite 0.5343493552168816 GULP 0.020164126611957794 Kinetix 0.0 LUDI 0.0023446658851113715 LibDock 0.06987104337631887 LigandFit 0.0032825322391559202 MCSS 0.0 MODELER 0.2398593200468933 MesoDyn 7.033997655334115E-4 Mesocite 0.0035169988276670576 Mesoscale 0.005627198124267292 Modules 0.0 Morphology 0.016178194607268465 ONETEP 4.689331770222743E-4 Polymorph 0.0023446658851113715 QMERA 0.0 QSAR 4.689331770222743E-4 Quantum Mechanics 0.4757327080890973 Reflex 0.052520515826494724 Reflex Plus 0.0011723329425556857 Semi-empirical 0.00492379835873388 Sorption 0.05744431418522861 Synthia 9.378663540445487E-4 TURBOMOLE 0.0 VAMP 7.033997655334115E-4 Visualization 0.6740914419695193 X-Cell 9.378663540445487E-4 ZDOCK 0.027667057444314185

Year

2023 5.461496450027307E-4 2024 0.3457127252867286 2025 1.0 2026 0.6477334789732386 2027 0.0

Keywords

target 1.0 potential 0.30243055555555554 analysis 0.21053240740740742 docking 0.20451388888888888 visualization 0.15925925925925927 between 0.15138888888888888 novel 0.09606481481481481 promising 0.08645833333333333 energy 0.084375 binding 0.06863425925925926 cell 0.06446759259259259 performance 0.04456018518518518 stability 0.04386574074074074 activity 0.043287037037037034 including 0.024189814814814813 effective 0.019328703703703702 mechanism 0.01724537037037037 development 0.016087962962962964 interaction 0.014930555555555556 experimental 0.013078703703703703 enhanced 0.011689814814814814 synthesized 0.011574074074074073 strong 0.009259259259259259 protein 5.787037037037037E-4 design 0.0
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