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Application

Discovery Studio 0.8476091476091476 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07507598784194529 Amorphous Cell 0.26778115501519756 Blends 0.00425531914893617 CASTEP 0.4890577507598784 CDOCKER 0.14711246200607903 CHARMm 0.23009118541033435 COMPASS 0.42006079027355625 COMPASS III 0.02735562310030395 COSMObase 3.0395136778115504E-4 COSMOconf 0.0012158054711246201 COSMOmic 3.0395136778115504E-4 COSMOperm 9.11854103343465E-4 COSMOplex 9.11854103343465E-4 COSMOquick 0.002127659574468085 COSMOtherm 0.07416413373860183 Catalyst 0.16261398176291794 Classical Simulations 1.0 Conformers 0.00364741641337386 Crystallization 0.08936170212765958 DFTB Plus 0.006382978723404255 DMol3 0.2547112462006079 DPD 0.004559270516717325 Discover 0.01094224924012158 Forcite 0.5337386018237082 GULP 0.04285714285714286 LUDI 0.005775075987841946 LibDock 0.06018237082066869 LigandFit 0.006686930091185411 MCSS 3.0395136778115504E-4 MODELER 0.06443768996960486 MesoDyn 0.00303951367781155 Mesocite 0.006382978723404255 Mesoscale 0.012462006079027355 Morphology 0.022796352583586626 ONETEP 0.002127659574468085 Polymorph 0.002127659574468085 QMERA 9.11854103343465E-4 QSAR 0.0024316109422492403 Quantum Mechanics 0.7243161094224924 Reflex 0.06474164133738602 Reflex Plus 9.11854103343465E-4 Reflex QPA 0.0 Semi-empirical 0.011246200607902736 Sorption 0.052279635258358666 Synthia 6.079027355623101E-4 TURBOMOLE 9.11854103343465E-4 VAMP 0.0033434650455927053 Visualization 0.8835866261398176 X-Cell 0.001519756838905775 ZDOCK 0.0243161094224924

Year

2023 0.0

Keywords

target 1.0 visualization 0.20609297244811264 docking 0.19274183760165067 potential 0.1882510013351135 between 0.15159606748391796 analysis 0.13229760893312295 energy 0.0875106202209006 novel 0.07148925840514625 binding 0.0504915645102561 cell 0.0504915645102561 interaction 0.049399198931909215 experimental 0.04636485010316786 activity 0.0401747784925355 synthesized 0.02888700084961767 mechanism 0.023303799004733585 chemical 0.019662580410243963 protein 0.019177084597645347 well 0.011530525549217139 synthesis 0.00801068090787717 promising 0.006311445563782012 stability 0.006190071610632358 higher 0.0033984706881903144 compound 0.001456487437795849 development 0.0010923655783468867 design 0.0
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