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Application

Discovery Studio 0.6196808510638298 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.044989775051124746 Amorphous Cell 0.2822085889570552 Blends 0.012269938650306749 CASTEP 0.3783231083844581 CDOCKER 0.12474437627811862 CHARMm 0.24130879345603273 COMPASS 0.43149284253578735 COMPASS III 0.012269938650306749 COSMOmic 0.0 COSMOtherm 0.03885480572597137 Catalyst 0.10429447852760736 Classical Simulations 1.0 Conformers 0.002044989775051125 Crystallization 0.053169734151329244 DFTB Plus 0.006134969325153374 DMol3 0.4376278118609407 DPD 0.014314928425357873 Discover 0.05930470347648262 Forcite 0.4539877300613497 GULP 0.05521472392638037 LUDI 0.0081799591002045 LibDock 0.024539877300613498 LigandFit 0.024539877300613498 MCSS 0.0 MODELER 0.21267893660531698 MesoDyn 0.006134969325153374 Mesocite 0.010224948875255624 Mesoscale 0.032719836400818 Morphology 0.016359918200409 ONETEP 0.006134969325153374 Polymorph 0.0 QSAR 0.0 Quantum Mechanics 0.7914110429447853 Reflex 0.028629856850715747 Reflex Plus 0.002044989775051125 Semi-empirical 0.012269938650306749 Sorption 0.04703476482617587 VAMP 0.00408997955010225 Visualization 0.5255623721881391 X-Cell 0.002044989775051125 ZDOCK 0.026584867075664622

Year

2003 0.09392265193370165 2004 0.016574585635359115 2005 0.027624309392265192 2006 0.0 2007 0.016574585635359115 2008 0.055248618784530384 2009 0.13812154696132597 2010 0.09944751381215469 2011 0.1270718232044199 2012 0.0718232044198895 2013 0.0055248618784530384 2014 0.24861878453038674 2015 0.4198895027624309 2016 0.143646408839779 2017 0.20994475138121546 2018 0.6464088397790055 2019 0.32044198895027626 2020 1.0 2021 0.425414364640884 2022 0.6187845303867403 2023 0.47513812154696133 2024 0.6685082872928176 2025 0.17679558011049723 2026 0.0055248618784530384

Keywords

interaction 1.0 target 0.9627659574468085 between 0.48936170212765956 energy 0.17553191489361702 analysis 0.15070921985815602 binding 0.14095744680851063 docking 0.13829787234042554 surface 0.10638297872340426 potential 0.10106382978723404 visualization 0.09485815602836879 mechanism 0.08599290780141844 experimental 0.0851063829787234 adsorption 0.0673758865248227 cell 0.054078014184397165 well 0.04875886524822695 strong 0.041666666666666664 protein 0.03900709219858156 chemical 0.03634751773049645 role 0.02925531914893617 formation 0.01950354609929078 complex 0.015070921985815602 higher 0.010638297872340425 activity 0.007978723404255319 novel 0.0035460992907801418 drug 0.0
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