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Application

Discovery Studio 1.0 Materials Studio 0.9720826709062003 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06761046761046761 Amorphous Cell 0.2784212784212784 Blends 0.0024024024024024023 CASTEP 0.393993993993994 CDOCKER 0.17434577434577433 CHARMm 0.26074646074646074 COMPASS 0.36413556413556414 COMPASS III 0.07824967824967825 COSMObase 0.0032604032604032604 COSMOconf 0.0036894036894036895 COSMOmic 1.716001716001716E-4 COSMOperm 0.0013728013728013728 COSMOplex 2.574002574002574E-4 COSMOquick 0.001287001287001287 COSMOtherm 0.06271986271986273 Cantera 0.0 Catalyst 0.12955812955812956 Classical Simulations 1.0 Conformers 8.58000858000858E-4 Crystallization 0.07378807378807378 DFTB Plus 0.005920205920205921 DMol3 0.17863577863577865 DPD 0.003003003003003003 Discover 0.0036894036894036895 Forcite 0.5324753324753325 GULP 0.02556842556842557 Kinetix 2.574002574002574E-4 LUDI 0.004976404976404976 LibDock 0.07198627198627199 LigandFit 0.006349206349206349 MCSS 9.438009438009438E-4 MODELER 0.18103818103818103 MesoDyn 0.0016302016302016302 Mesocite 0.004204204204204204 Mesoscale 0.007807807807807808 Modules 0.0 Morphology 0.017417417417417418 ONETEP 9.438009438009438E-4 Polymorph 0.0018876018876018876 QMERA 2.574002574002574E-4 QSAR 0.0011154011154011153 Quantum Mechanics 0.5621621621621622 Reflex 0.05405405405405406 Reflex Plus 7.722007722007722E-4 Semi-empirical 0.007893607893607893 Sorption 0.05405405405405406 Synthia 0.0014586014586014586 TURBOMOLE 6.006006006006006E-4 VAMP 0.0015444015444015444 Visualization 0.8691548691548692 X-Cell 0.0012012012012012011 ZDOCK 0.03028743028743029

Year

2021 0.03286590709903593 2022 0.2747589833479404 2023 0.37835232252410167 2024 0.8514460999123575 2025 1.0 2026 0.37256792287467133 2027 0.0

Keywords

target 1.0 potential 0.2713138498771589 docking 0.2225074254702798 visualization 0.2123134465182795 analysis 0.18525173260973196 between 0.1515896006747094 novel 0.10193978952000293 energy 0.08191852150636207 binding 0.07319130211580066 cell 0.060467162920318285 activity 0.05295002016794397 promising 0.04990649407795827 interaction 0.03846576949873492 stability 0.03186535147225991 synthesized 0.030508598877928936 experimental 0.027575079755051152 protein 0.02112133768472003 performance 0.02060797183821642 effective 0.019214550254849475 mechanism 0.01818781856184225 development 0.01752777675919475 synthesis 0.01353085695427377 including 0.012357449305122658 design 9.900627039712514E-4 chemical 0.0
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