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Application

Discovery Studio 0.09802963686695979 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06924437705332323 Amorphous Cell 0.17791256002021733 Blends 0.0037907505686125853 CASTEP 0.6982562547384382 CDOCKER 0.030578721253474855 CHARMm 0.07808946171341925 COMPASS 0.3371240839019459 COMPASS III 0.008086934546373515 COSMObase 5.054334091483447E-4 COSMOconf 0.001516300227445034 COSMOmic 0.001516300227445034 COSMOperm 5.054334091483447E-4 COSMOplex 0.0 COSMOquick 2.5271670457417233E-4 COSMOtherm 0.12206216830932524 Catalyst 0.04902704068738944 Classical Simulations 0.7371746272428608 Conformers 0.002274450341167551 Crystallization 0.05281779125600202 DFTB Plus 0.0017690169320192064 DMol3 0.3179176143543088 DPD 0.014404852160727824 Discover 0.06469547637098812 Forcite 0.28834975991913064 GULP 0.12686378569623452 Kinetix 0.0 LUDI 0.005054334091483447 LibDock 0.011372251705837756 LigandFit 0.011624968410411928 MCSS 0.0010108668182966893 MODELER 0.07379327773565833 MesoDyn 0.005812484205205964 Mesocite 0.00530705079605762 Mesoscale 0.022239070002527166 Morphology 0.017437452615617893 ONETEP 0.0037907505686125853 Polymorph 0.003032600454890068 QMERA 2.5271670457417233E-4 QSAR 0.004548900682335102 Quantum Mechanics 1.0 Reflex 0.03083143795804903 Reflex Plus 0.0025271670457417236 Reflex QPA 0.0 Semi-empirical 0.010108668182966895 Sorption 0.030326004548900682 Synthia 0.002274450341167551 TURBOMOLE 0.001516300227445034 VAMP 0.0075815011372251705 Visualization 0.1491028556987617 X-Cell 0.002274450341167551 ZDOCK 0.007834217841799343

Year

2003 0.02152317880794702 2004 0.09685430463576158 2005 0.12251655629139073 2006 0.16556291390728478 2007 0.19288079470198677 2008 0.2640728476821192 2009 0.2955298013245033 2010 0.402317880794702 2011 0.4031456953642384 2012 0.35596026490066224 2013 0.347682119205298 2014 0.3741721854304636 2015 0.39155629139072845 2016 0.37996688741721857 2017 0.20447019867549668 2018 0.12251655629139073 2019 0.1804635761589404 2020 0.39486754966887416 2021 0.2723509933774834 2022 1.0 2023 0.5 2024 0.10430463576158941 2025 0.12251655629139073 2026 0.04552980132450331 2027 0.0

Keywords

experimental 1.0 target 0.9348268839103869 between 0.24738628649015615 energy 0.1846571622539036 well 0.13116089613034623 chemical 0.1143245078071962 analysis 0.09463679565512559 surface 0.0835030549898167 potential 0.056890699253224715 temperature 0.05241004752206382 adsorption 0.048879837067209775 interaction 0.04494229463679566 cell 0.0418194161575017 applied 0.0328581126951799 order 0.026883910386965377 crystal 0.024032586558044806 higher 0.01737949762389681 mechanism 0.016293279022403257 formation 0.013441955193482688 type 0.007060420909708078 x-ray 0.0062457569585879155 water 0.005159538357094365 predicted 0.0010862186014935506 band 6.788866259334691E-4 including 0.0
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