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Application

Discovery Studio 0.07520891364902507 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.028897136797454932 Amorphous Cell 0.1147932131495228 Blends 0.0029162248144220574 CASTEP 0.5967656415694592 CDOCKER 0.015641569459172854 CHARMm 0.04480381760339343 COMPASS 0.19883351007423117 COMPASS III 0.0071580063626723225 COSMObase 2.651113467656416E-4 COSMOconf 5.302226935312832E-4 COSMOmic 0.0 COSMOtherm 0.03128313891834571 Catalyst 0.019618239660657476 Classical Simulations 0.49204665959703076 Conformers 0.0023860021208907743 Crystallization 0.04559915164369035 DFTB Plus 0.001325556733828208 DMol3 0.41728525980911985 DPD 0.0029162248144220574 Discover 0.027571580063626724 Forcite 0.2022799575821845 GULP 0.10975609756097561 LUDI 0.0023860021208907743 LibDock 0.00503711558854719 LigandFit 0.005832449628844115 MODELER 0.038441145281018024 MesoDyn 0.001855779427359491 Mesocite 0.001325556733828208 Mesoscale 0.006097560975609756 Morphology 0.013255567338282079 ONETEP 0.005302226935312832 Polymorph 0.00503711558854719 QMERA 2.651113467656416E-4 QSAR 0.002651113467656416 Quantum Mechanics 1.0 Reflex 0.028897136797454932 Reflex Plus 0.0010604453870625664 Semi-empirical 0.0076882290562036056 Sorption 0.024390243902439025 Synthia 7.953340402969247E-4 TURBOMOLE 0.0010604453870625664 VAMP 0.005567338282078473 Visualization 0.08536585365853659 X-Cell 0.001325556733828208 ZDOCK 0.0034464475079533405

Year

2003 8.59106529209622E-4 2004 0.07560137457044673 2005 0.09621993127147767 2006 0.15206185567010308 2007 0.20532646048109965 2008 0.26374570446735396 2009 0.28780068728522334 2010 0.35652920962199314 2011 0.38402061855670105 2012 0.13058419243986255 2013 0.015463917525773196 2014 0.0781786941580756 2015 0.14604810996563575 2016 0.1134020618556701 2017 0.0 2018 0.12371134020618557 2019 0.08505154639175258 2020 0.34536082474226804 2021 0.2920962199312715 2022 1.0 2023 0.10652920962199312 2024 0.13058419243986255 2025 0.0661512027491409 2026 0.018900343642611683

Keywords

energy 1.0 target 0.9220566860465116 between 0.24963662790697674 experimental 0.17078488372093023 surface 0.11482558139534883 well 0.07485465116279069 potential 0.0728561046511628 analysis 0.06631540697674419 chemical 0.0625 interaction 0.061046511627906974 band 0.060501453488372096 stable 0.047238372093023256 adsorption 0.04451308139534884 higher 0.0403343023255814 stability 0.035065406976744186 applied 0.030523255813953487 formation 0.021075581395348836 temperature 0.015261627906976744 cell 0.013263081395348836 crystal 0.010901162790697675 mechanism 0.006722383720930232 hydrogen 0.0030886627906976743 increase 7.267441860465116E-4 order 7.267441860465116E-4 lower 0.0
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