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Application

Discovery Studio 0.8634326390719747 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0815811606391926 Amorphous Cell 0.251892346509672 Blends 0.005046257359125316 CASTEP 0.5811606391925989 CDOCKER 0.18713204373423045 CHARMm 0.23296888141295205 COMPASS 0.42430613961312025 COMPASS III 0.013036164844407064 COSMObase 4.2052144659377626E-4 COSMOconf 4.2052144659377626E-4 COSMOmic 0.0 COSMOperm 0.001261564339781329 COSMOplex 0.0 COSMOquick 0.001261564339781329 COSMOtherm 0.08620689655172414 Catalyst 0.1564339781328848 Classical Simulations 1.0 Conformers 0.001682085786375105 Crystallization 0.08915054667788057 DFTB Plus 0.00798990748528175 DMol3 0.28469301934398655 DPD 0.009251471825063078 Discover 0.022708158116063918 Forcite 0.48359966358284273 GULP 0.043313708999158956 LUDI 0.00798990748528175 LibDock 0.07569386038687972 LigandFit 0.008830950378469302 MCSS 0.002523128679562658 MODELER 0.09629941126997477 MesoDyn 0.00336417157275021 Mesocite 0.009671993271656855 Mesoscale 0.01892346509671993 Morphology 0.022708158116063918 ONETEP 0.0037846930193439865 Polymorph 0.00336417157275021 QMERA 4.2052144659377626E-4 QSAR 0.004205214465937763 Quantum Mechanics 0.8519764507989908 Reflex 0.06307821698906645 Reflex Plus 0.001261564339781329 Semi-empirical 0.01471825063078217 Sorption 0.04709840201850295 Synthia 4.2052144659377626E-4 TURBOMOLE 0.001261564339781329 VAMP 0.0054667788057190915 Visualization 0.9693019343986543 X-Cell 0.0 ZDOCK 0.037426408746846086

Year

2022 0.0

Keywords

target 1.0 visualization 0.21017565112053302 docking 0.17655966081162933 potential 0.1689884918231375 between 0.1594488188976378 analysis 0.11977589339794065 energy 0.09161114476075106 novel 0.07253179890975167 experimental 0.06571774682010903 interaction 0.054209569957601456 binding 0.05178679588128407 activity 0.04830405814657783 cell 0.044215626892792244 well 0.033161720169594185 synthesized 0.03043609933373713 chemical 0.02786190187764991 mechanism 0.024076317383403996 synthesis 0.02059357964869776 surface 0.018170805572380374 protein 0.015142337976983646 design 0.009539672925499697 higher 0.009539672925499697 promising 0.0060569351907934586 stability 0.004996971532404603 adsorption 0.0
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