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Application

Discovery Studio 1.0 Materials Studio 0.630901287553648 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.052535404294198264 Amorphous Cell 0.23892188213796253 Blends 0.001827318410232983 CASTEP 0.25308359981726813 CDOCKER 0.2284148012791229 CHARMm 0.36455002284148014 COMPASS 0.28551850159890363 COMPASS III 0.10507080858839653 COSMObase 0.0045682960255824575 COSMOconf 0.006852444038373686 COSMOmic 0.0 COSMOperm 9.136592051164915E-4 COSMOplex 4.5682960255824577E-4 COSMOquick 0.0 COSMOtherm 0.06258565555047967 Catalyst 0.09776153494746459 Classical Simulations 1.0 Conformers 4.5682960255824577E-4 Crystallization 0.06624029237094564 DFTB Plus 0.0031978072179077205 DMol3 0.11603471904979443 DPD 0.0013704888076747374 Discover 0.0022841480127912287 Forcite 0.45180447693010506 GULP 0.012334399269072635 Kinetix 0.0 LUDI 0.00548195523069895 LibDock 0.09365006852444038 LigandFit 0.0045682960255824575 MODELER 0.3362265874828689 Mesocite 0.002740977615349475 Mesoscale 0.003654636820465966 Morphology 0.015532206486980357 ONETEP 9.136592051164915E-4 Polymorph 0.0022841480127912287 Quantum Mechanics 0.36455002284148014 Reflex 0.04659661946094107 Reflex Plus 0.0 Semi-empirical 0.004111466423024212 Sorption 0.053905893101873 Synthia 9.136592051164915E-4 TURBOMOLE 0.0 VAMP 4.5682960255824577E-4 Visualization 0.8492462311557789 X-Cell 9.136592051164915E-4 ZDOCK 0.03883051621745089

Year

2024 0.11083819465766043 2025 1.0 2026 0.76327909118821 2027 0.0

Keywords

target 1.0 potential 0.3258620689655172 docking 0.27088122605363985 analysis 0.21666666666666667 visualization 0.1835249042145594 binding 0.10804597701149425 between 0.10402298850574712 novel 0.09367816091954023 promising 0.08946360153256705 activity 0.0685823754789272 cell 0.03620689655172414 including 0.031800766283524906 stability 0.027969348659003832 strong 0.02567049808429119 protein 0.024521072796934867 therapeutic 0.02432950191570881 energy 0.022796934865900384 development 0.01934865900383142 effective 0.013793103448275862 synthesized 0.01053639846743295 mechanism 0.0072796934865900385 interaction 0.0053639846743295016 silico 0.0017241379310344827 synthesis 7.662835249042146E-4 inhibition 0.0
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