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Application

Discovery Studio 1.0 Materials Studio 0.6131623931623932 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07464676086376966 Amorphous Cell 0.2777925886430285 Antibody 5.331911490269261E-4 Blends 0.005865102639296188 CASTEP 0.17435350573180486 CDOCKER 0.20554518794988003 CHARMm 0.350573180485204 COMPASS 0.37803252466009063 COMPASS III 0.04318848307118102 COSMObase 0.0010663822980538523 COSMOconf 0.0018661690215942416 COSMOmic 5.331911490269261E-4 COSMOperm 7.997867235403892E-4 COSMOplex 2.6659557451346307E-4 COSMOquick 0.0010663822980538523 COSMOtherm 0.047454012263396426 Catalyst 0.14396161023727005 Classical Simulations 1.0 Conformers 7.997867235403892E-4 Crystallization 0.03625699813383098 DFTB Plus 0.008264462809917356 DMol3 0.1812849906691549 DPD 0.003732338043188483 Discover 0.011463609704078913 Forcite 0.47374033591042386 GULP 0.014129565449213543 LUDI 0.01039722740602506 LibDock 0.07811250333244468 LigandFit 0.022127432684617435 MCSS 0.0013329778725673154 MODELER 0.30498533724340177 MesoDyn 0.0015995734470807784 Mesocite 0.006664889362836577 Mesoscale 0.010130631831511597 Morphology 0.014929352172753933 ONETEP 0.0015995734470807784 Polymorph 0.0010663822980538523 QMERA 0.0 QSAR 0.0010663822980538523 Quantum Mechanics 0.3415089309517462 Reflex 0.02079445481205012 Reflex Plus 5.331911490269261E-4 Semi-empirical 0.01039722740602506 Sorption 0.046654225539856035 Synthia 5.331911490269261E-4 TURBOMOLE 5.331911490269261E-4 VAMP 0.0015995734470807784 Visualization 0.8659024260197281 X-Cell 5.331911490269261E-4 ZDOCK 0.06398293788323114

Year

2010 0.0045 2011 0.0215 2012 0.0305 2013 0.044 2014 0.0595 2015 0.061 2016 0.073 2017 0.081 2018 0.1075 2019 0.2115 2020 0.39 2021 0.479 2022 0.561 2023 0.831 2024 1.0 2025 0.8275 2026 0.2005 2027 0.0

Keywords

interaction 1.0 target 0.9585474077533863 between 0.4245679588977114 docking 0.32157870154133583 potential 0.22874824848201775 analysis 0.22641289117234936 visualization 0.21660439047174218 binding 0.20761326482951892 protein 0.10976179355441383 energy 0.10719290051377861 mechanism 0.0948155067725362 cell 0.06188696870621205 novel 0.06048575432041102 activity 0.0517281644091546 experimental 0.04110228865016347 drug 0.02849135917795423 complex 0.026389537599252687 stability 0.016581036898645492 role 0.015646893974778142 well 0.011560018682858478 surface 0.008173750583839328 development 0.002335357309668379 higher 0.0016347501167678655 silico 8.173750583839327E-4 strong 0.0
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