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Application

Discovery Studio 0.7966725323948168 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.11634756995581738 Amorphous Cell 0.1434462444771723 Antibody 0.0 Blends 0.003240058910162003 CASTEP 0.675699558173785 CDOCKER 0.2524300441826215 CHARMm 0.28394698085419734 COMPASS 0.33814432989690724 COMPASS III 0.025920471281296025 COSMOconf 2.945508100147275E-4 COSMOperm 0.0 COSMOquick 5.89101620029455E-4 COSMOtherm 0.03593519882179676 Catalyst 0.2898379970544919 Classical Simulations 0.9982326951399116 Conformers 0.0017673048600883653 Crystallization 0.18262150220913106 DFTB Plus 0.006480117820324006 DMol3 0.3422680412371134 DPD 0.008541973490427098 Discover 0.030927835051546393 Equilibria 0.0 Forcite 0.4235640648011782 GULP 0.03505154639175258 LUDI 0.010603829160530192 LibDock 0.06273932253313697 LigandFit 0.0288659793814433 MCSS 0.003829160530191458 MODELER 0.1487481590574374 MesoDyn 0.004123711340206186 Mesocite 0.004123711340206186 Mesoscale 0.015316642120765831 Morphology 0.02268041237113402 ONETEP 2.945508100147275E-4 Polymorph 0.006774668630338734 QMERA 8.836524300441826E-4 QSAR 0.0029455081001472753 Quantum Mechanics 1.0 Reflex 0.1452135493372607 Reflex Plus 0.011192930780559647 Semi-empirical 0.016200294550810016 Sorption 0.05272459499263623 Synthia 0.0029455081001472753 TURBOMOLE 2.945508100147275E-4 VAMP 0.008247422680412371 Visualization 0.8701030927835052 X-Cell 0.005301914580265096 ZDOCK 0.006774668630338734

Year

2001 0.0 2002 0.0014914243102162564 2003 0.0 2004 0.011185682326621925 2005 0.011931394481730051 2006 0.023117076808351976 2007 0.02609992542878449 2008 0.04399701715137957 2009 0.0686055182699478 2010 0.0842654735272185 2011 0.1185682326621924 2012 0.14466815809097688 2013 0.23415361670395227 2014 0.29008202833706187 2015 0.3698732289336316 2016 0.35570469798657717 2017 0.4407158836689038 2018 0.5249813571961223 2019 0.6524981357196122 2020 0.6674123788217748 2021 0.686055182699478 2022 0.9313944817300522 2023 0.9821029082774049 2024 1.0 2025 0.7233407904548844 2026 0.24683072334079045

Keywords

synthesized 1.0 target 0.9691413686003406 synthesis 0.30337641518885883 novel 0.21060014026650636 docking 0.19126340046087567 potential 0.1532912533814247 compound 0.13866346057509268 visualization 0.13455565574591724 between 0.09227532311391644 analysis 0.08686504358280733 activity 0.08415990381725277 designed 0.058511171225328125 experimental 0.050996894098787694 design 0.0492936579501052 promising 0.035367197675583606 binding 0.033163009718465086 potent 0.026550445847109506 energy 0.025648732591924656 inhibition 0.02184149884781084 well 0.01703236148682497 x-ray 0.014026650636208797 vitro 0.013625889189459974 chemical 0.010419797615469392 cell 0.006011421701232342 active 0.0
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