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Application

Discovery Studio 1.0 Materials Studio 0.4112016293279022 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04234769687964339 Amorphous Cell 0.1459881129271917 Blends 0.0018573551263001485 CASTEP 0.21322436849925705 CDOCKER 0.22102526002971767 CHARMm 0.3547548291233284 COMPASS 0.2336552748885587 COMPASS III 0.02488855869242199 COSMObase 3.714710252600297E-4 COSMOconf 3.714710252600297E-4 COSMOperm 7.429420505200594E-4 COSMOquick 3.714710252600297E-4 COSMOtherm 0.029346210995542348 Catalyst 0.14895988112927191 Classical Simulations 0.7860326894502229 Conformers 3.714710252600297E-4 Crystallization 0.05200594353640416 DFTB Plus 0.004457652303120356 DMol3 0.09955423476968796 DPD 0.001114413075780089 Discover 0.0 Forcite 0.2964338781575037 GULP 0.019316493313521546 Kinetix 0.0 LUDI 0.003714710252600297 LibDock 0.09435364041604755 LigandFit 0.006686478454680535 MCSS 0.001114413075780089 MODELER 0.3354383358098068 MesoDyn 0.0014858841010401188 Mesocite 0.002228826151560178 Mesoscale 0.005200594353640416 Morphology 0.01263001485884101 ONETEP 0.0 Polymorph 7.429420505200594E-4 QSAR 3.714710252600297E-4 Quantum Mechanics 0.3075780089153046 Reflex 0.038261515601783064 Semi-empirical 0.006686478454680535 Sorption 0.030089153046062408 Synthia 0.0014858841010401188 TURBOMOLE 7.429420505200594E-4 VAMP 0.0018573551263001485 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03714710252600297

Year

2024 0.0

Keywords

target 1.0 docking 0.3541100543478261 potential 0.3420516304347826 visualization 0.2712296195652174 analysis 0.22265625 binding 0.1253396739130435 between 0.11548913043478261 novel 0.11430027173913043 activity 0.09391983695652174 protein 0.07116168478260869 promising 0.04551630434782609 interaction 0.038892663043478264 vitro 0.026664402173913044 silico 0.026324728260869564 synthesis 0.020550271739130436 drug 0.017153532608695652 synthesized 0.014266304347826086 compound 0.013247282608695652 development 0.008661684782608696 cell 0.005095108695652174 treatment 0.004755434782608696 effective 0.00390625 including 0.002717391304347826 stability 0.0022078804347826085 therapeutic 0.0
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