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Application

Discovery Studio 1.0 Materials Studio 0.8779360800924143 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06484149855907781 Amorphous Cell 0.08501440922190202 Blends 7.204610951008645E-4 CASTEP 0.542507204610951 CDOCKER 0.3645533141210375 CHARMm 0.4020172910662824 COMPASS 0.23991354466858789 COMPASS III 0.009365994236311239 COSMObase 7.204610951008645E-4 COSMOconf 0.001440922190201729 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.001440922190201729 COSMOtherm 0.0569164265129683 Catalyst 0.4207492795389049 Classical Simulations 1.0 Conformers 0.008645533141210375 Crystallization 0.16786743515850144 DFTB Plus 0.007204610951008645 DMol3 0.43515850144092216 DPD 0.005043227665706052 Discover 0.025936599423631124 Forcite 0.3090778097982709 GULP 0.0792507204610951 LUDI 0.019452449567723344 LibDock 0.07853025936599424 LigandFit 0.07060518731988473 MCSS 0.005043227665706052 MODELER 0.28170028818443804 MesoDyn 0.007204610951008645 Mesocite 0.0036023054755043226 Mesoscale 0.01585014409221902 Morphology 0.018011527377521614 Polymorph 0.0036023054755043226 QMERA 7.204610951008645E-4 QSAR 0.005043227665706052 Quantum Mechanics 0.9531700288184438 Reflex 0.1361671469740634 Reflex Plus 0.010086455331412104 Reflex QPA 0.0 Semi-empirical 0.018011527377521614 Sorption 0.02881844380403458 Synthia 0.001440922190201729 TURBOMOLE 7.204610951008645E-4 VAMP 0.008645533141210375 Visualization 0.9488472622478387 X-Cell 0.012247838616714697 ZDOCK 0.006484149855907781

Year

2003 0.0 2004 0.02676864244741874 2005 0.0248565965583174 2006 0.05736137667304015 2007 0.08986615678776291 2008 0.10133843212237094 2009 0.13766730401529637 2010 0.18546845124282982 2011 0.18738049713193117 2012 0.2390057361376673 2013 0.5468451242829828 2014 0.5889101338432122 2015 0.7074569789674953 2016 0.627151051625239 2017 0.7973231357552581 2018 0.8489483747609943 2019 0.6711281070745698 2020 0.7667304015296367 2021 0.8126195028680688 2022 1.0 2023 0.5258126195028681 2024 0.5583173996175909 2025 0.08221797323135756 2026 0.022944550669216062

Keywords

synthesis 1.0 target 0.9664716471647165 synthesized 0.36836183618361834 novel 0.23334833483348336 docking 0.1905940594059406 design 0.15031503150315031 visualization 0.14581458145814583 compound 0.14266426642664268 potential 0.13096309630963096 activity 0.12713771377137714 between 0.07605760576057606 potent 0.06368136813681369 analysis 0.050855085508550855 designed 0.036453645364536456 medicinal 0.03577857785778578 chemical 0.03217821782178218 inhibition 0.030153015301530153 binding 0.029252925292529253 catalyst 0.028127812781278128 well 0.021827182718271828 experimental 0.02115211521152115 promising 0.020927092709270928 vitro 0.017326732673267328 active 0.013051305130513051 x-ray 0.0
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