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Application

Discovery Studio 1.0 Materials Studio 0.8883034773445733 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06596306068601583 Amorphous Cell 0.09036939313984169 Blends 6.596306068601583E-4 CASTEP 0.5395778364116095 CDOCKER 0.3641160949868074 CHARMm 0.3924802110817942 COMPASS 0.24010554089709762 COMPASS III 0.013852242744063324 COSMObase 6.596306068601583E-4 COSMOconf 6.596306068601583E-4 COSMOperm 0.0 COSMOquick 6.596306068601583E-4 COSMOtherm 0.055408970976253295 Catalyst 0.42810026385224276 Classical Simulations 1.0 Conformers 0.0079155672823219 Crystallization 0.17810026385224276 DFTB Plus 0.0079155672823219 DMol3 0.4465699208443272 DPD 0.00395778364116095 Discover 0.02836411609498681 Forcite 0.31200527704485487 GULP 0.08179419525065963 LUDI 0.01912928759894459 LibDock 0.08245382585751979 LigandFit 0.06266490765171503 MCSS 0.00395778364116095 MODELER 0.28298153034300794 MesoDyn 0.008575197889182058 Mesocite 0.0032981530343007917 Mesoscale 0.0158311345646438 Morphology 0.01912928759894459 Polymorph 0.004617414248021108 QMERA 6.596306068601583E-4 QSAR 0.005936675461741424 Quantum Mechanics 0.9630606860158312 Reflex 0.14182058047493404 Reflex Plus 0.011873350923482849 Reflex QPA 6.596306068601583E-4 Semi-empirical 0.01978891820580475 Sorption 0.03496042216358839 Synthia 0.0013192612137203166 TURBOMOLE 0.0013192612137203166 VAMP 0.009894459102902375 Visualization 0.9472295514511874 X-Cell 0.015171503957783642 ZDOCK 0.006596306068601583

Year

2003 0.005474452554744526 2004 0.032846715328467155 2005 0.029197080291970802 2006 0.060218978102189784 2007 0.09124087591240876 2008 0.10218978102189781 2009 0.13686131386861314 2010 0.1843065693430657 2011 0.19525547445255476 2012 0.23357664233576642 2013 0.5237226277372263 2014 0.6186131386861314 2015 0.7992700729927007 2016 0.6478102189781022 2017 0.7974452554744526 2018 0.8996350364963503 2019 1.0 2020 0.7518248175182481 2021 0.8175182481751825 2022 0.864963503649635 2023 0.7937956204379562 2024 0.4251824817518248 2025 0.177007299270073 2026 0.043795620437956206 2027 0.0

Keywords

synthesis 1.0 target 0.968019680196802 synthesized 0.36961869618696186 novel 0.22857728577285774 docking 0.1916769167691677 design 0.14719147191471915 visualization 0.14145141451414514 compound 0.14022140221402213 potential 0.13017630176301764 activity 0.12607626076260764 between 0.06970069700697007 potent 0.05822058220582206 analysis 0.05350553505535055 designed 0.03792537925379254 medicinal 0.033210332103321034 chemical 0.03034030340303403 inhibition 0.029315293152931528 catalyst 0.02870028700287003 binding 0.026650266502665027 well 0.02234522345223452 vitro 0.017220172201722016 promising 0.017015170151701516 experimental 0.015990159901599015 active 0.011275112751127511 energy 0.0
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