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Application

Discovery Studio 1.0 Materials Studio 0.9901020486457455 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06626323751891074 Amorphous Cell 0.27866868381240545 Blends 0.002319717599596571 CASTEP 0.3875945537065053 CDOCKER 0.16782652546646495 CHARMm 0.25940494200706 COMPASS 0.3610690872415532 COMPASS III 0.08461926374180534 COSMObase 0.0037317196167423097 COSMOconf 0.0043368633383761976 COSMOmic 1.0085728693898134E-4 COSMOperm 0.0013111447302067575 COSMOplex 3.02571860816944E-4 COSMOquick 0.0014120020171457387 COSMOtherm 0.06343923348461926 Cantera 0.0 Catalyst 0.12193645990922844 Classical Simulations 1.0 Conformers 7.060010085728693E-4 Crystallization 0.07291981845688351 DFTB Plus 0.005748865355521936 DMol3 0.1746848209783157 DPD 0.0027231467473524964 Discover 0.004034291477559254 Forcite 0.5326273323247604 GULP 0.02460917801311145 Kinetix 2.0171457387796267E-4 LUDI 0.004034291477559254 LibDock 0.07170953101361574 LigandFit 0.005042864346949067 MCSS 6.05143721633888E-4 MODELER 0.19283913262733232 MesoDyn 0.001210287443267776 Mesocite 0.004034291477559254 Mesoscale 0.0070600100857286935 Modules 0.0 Morphology 0.01714573877962683 ONETEP 0.0010085728693898135 Polymorph 0.002118003025718608 QMERA 2.0171457387796267E-4 QSAR 0.0011094301563287948 Quantum Mechanics 0.5508825012607161 Reflex 0.053151790216843166 Reflex Plus 9.07715582450832E-4 Semi-empirical 0.007564296520423601 Sorption 0.05516893595562279 Synthia 0.0016137165910237014 TURBOMOLE 4.0342914775592535E-4 VAMP 0.0014120020171457387 Visualization 0.8380231971759959 X-Cell 0.0014120020171457387 ZDOCK 0.029551185073121534

Year

2021 0.002861230329041488 2022 0.13572961373390557 2023 0.3116058655221745 2024 0.6579041487839771 2025 1.0 2026 0.3800071530758226 2027 0.0

Keywords

target 1.0 potential 0.28294914657751186 docking 0.22404539855710012 visualization 0.20684497624494105 analysis 0.19333978532465249 between 0.15541967270807672 novel 0.10293858877353511 energy 0.0863100475101179 binding 0.07372866443779694 cell 0.06422664085870139 promising 0.060047510117895476 activity 0.05503255322892838 stability 0.03726024986802745 interaction 0.03682034136899525 synthesized 0.0323332746788668 experimental 0.03070561323244765 performance 0.027626253739222242 protein 0.021731479852190743 development 0.021203589653352103 effective 0.020631708604610242 mechanism 0.02014780925567482 including 0.018080239310223473 synthesis 0.014516980468062643 design 0.003915185641386591 chemical 0.0
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