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Application

Discovery Studio 1.0 Materials Studio 0.568608202443281 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06333765672287073 Amorphous Cell 0.14764375270211846 Antibody 4.3233895373973193E-4 Blends 0.0034587116299178555 CASTEP 0.38780804150453957 CDOCKER 0.38305231301340253 CHARMm 0.47816688283614356 COMPASS 0.2637267617812365 COMPASS III 0.030696065715520967 COSMObase 0.0012970168612191958 COSMOconf 2.1616947686986597E-4 COSMOperm 2.1616947686986597E-4 COSMOplex 0.0 COSMOquick 0.00216169476869866 COSMOtherm 0.0520968439256377 Catalyst 0.3865110246433204 Classical Simulations 1.0 Conformers 6.485084306095979E-4 Crystallization 0.07220060527453523 DFTB Plus 0.0038910505836575876 DMol3 0.2155209684392564 DPD 0.005836575875486381 Discover 0.014051015996541289 Forcite 0.33960224816255946 GULP 0.020103761348897537 LUDI 0.02594033722438392 LibDock 0.12905317769131 LigandFit 0.05490704712494596 MCSS 0.004971897968006917 MODELER 0.37937743190661477 MesoDyn 0.00324254215304799 Mesocite 0.005620406398616515 Mesoscale 0.012105490704712495 Morphology 0.011456982274102896 ONETEP 0.0023778642455685255 Polymorph 0.0034587116299178555 QMERA 2.1616947686986597E-4 QSAR 0.00216169476869866 Quantum Mechanics 0.5938175529615218 Reflex 0.057068741893644616 Reflex Plus 0.0015131863380890619 Reflex QPA 0.0 Semi-empirical 0.005836575875486381 Sorption 0.025075659316904454 Synthia 6.485084306095979E-4 TURBOMOLE 2.1616947686986597E-4 VAMP 0.0012970168612191958 Visualization 0.9169909208819714 X-Cell 0.0028102031993082577 ZDOCK 0.03869433635970601

Year

1999 0.0 2000 0.0 2001 0.0 2002 0.0020300446609825416 2003 0.00243605359317905 2004 0.0028420625253755584 2005 0.004466098254161592 2006 0.007308160779537149 2007 0.00933820544051969 2008 0.015834348355663823 2009 0.022330491270807957 2010 0.033698741372310194 2011 0.061713357693869264 2012 0.06942752740560293 2013 0.09987819732034105 2014 0.1027202598457166 2015 0.14819326025172555 2016 0.21559074299634592 2017 0.24766544863987008 2018 0.29963459196102316 2019 0.33576938692651237 2020 0.39748274462038163 2021 0.5131952902963866 2022 0.6293138449045879 2023 0.758830694275274 2024 1.0 2025 0.9220462850182704 2026 0.2298010556232237 2027 4.060089321965083E-4

Keywords

novel 1.0 target 0.9647723753484051 potential 0.267187983895943 docking 0.25766491173738 visualization 0.1598792195726231 synthesized 0.1359554041498916 analysis 0.13014865283369464 activity 0.10854753793744193 synthesis 0.10692164756890678 binding 0.08663672963765871 between 0.0836172189532363 compound 0.08144936512852276 design 0.07277794982966863 development 0.06457107463611025 promising 0.06418395788169712 protein 0.033292040879529264 drug 0.03213069061628987 potent 0.029266026633632702 inhibition 0.023691545370083618 cell 0.01889129761536079 vitro 0.01819448745741716 effective 0.003096934035305048 energy 0.001548467017652524 designed 2.322700526478786E-4 well 0.0
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