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Application

Discovery Studio 0.2547788093937739 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06357670221493027 Amorphous Cell 0.1279737489745693 Blends 0.004922067268252666 CASTEP 0.5377358490566038 CDOCKER 0.07957342083675144 CHARMm 0.11853978671041837 COMPASS 0.3137817883511075 COMPASS III 0.012305168170631665 COSMObase 0.0012305168170631665 COSMOconf 8.203445447087777E-4 COSMOmic 4.1017227235438887E-4 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.002461033634126333 COSMOtherm 0.13863822805578344 Catalyst 0.12018047579983593 Classical Simulations 0.734208367514356 Conformers 0.002871205906480722 Crystallization 0.0808039376538146 DFTB Plus 0.009844134536505332 DMol3 0.4700574241181296 DPD 0.010254306808859722 Discover 0.04716981132075472 Forcite 0.2973748974569319 GULP 0.08367514356029532 LUDI 0.01394585726004922 LibDock 0.022969647251845776 LigandFit 0.019278096800656275 MCSS 0.002050861361771944 MODELER 0.09762100082034454 MesoDyn 0.0012305168170631665 Mesocite 0.002871205906480722 Mesoscale 0.01394585726004922 Morphology 0.01066447908121411 ONETEP 0.013535684987694831 Polymorph 0.006562756357670222 QSAR 0.008203445447087777 Quantum Mechanics 1.0 Reflex 0.06029532403609516 Reflex Plus 0.003281378178835111 Semi-empirical 0.02091878589007383 Sorption 0.022149302707136997 Synthia 0.002871205906480722 TURBOMOLE 0.002050861361771944 VAMP 0.009844134536505332 Visualization 0.2940935192780968 X-Cell 0.002871205906480722 ZDOCK 0.007383100902378999

Year

2004 0.054 2005 0.08 2006 0.106 2007 0.114 2008 0.178 2009 0.22 2010 0.298 2011 0.316 2012 0.332 2013 0.444 2014 0.578 2015 0.61 2016 0.636 2017 0.656 2018 0.752 2019 0.778 2020 0.666 2021 0.496 2022 1.0 2023 0.882 2024 0.856 2025 0.108 2026 0.0

Keywords

chemical 1.0 target 0.9567364677992888 between 0.221058870011853 experimental 0.18569735282497038 energy 0.14006321612011063 potential 0.10331884630580798 surface 0.09640458316870802 analysis 0.08474911102331094 well 0.0841564598972738 novel 0.06262346898459108 adsorption 0.057882259976293954 interaction 0.04385618332674832 visualization 0.03160806005531411 mechanism 0.019952587909917028 higher 0.018964836033188465 including 0.018174634531805612 formation 0.014223627024891347 temperature 0.014026076649545634 synthesized 0.012050572896088503 docking 0.010470169893322797 binding 0.00434610825760569 cell 0.0031608060055314103 applied 0.002370604504148558 form 7.902015013828526E-4 type 0.0
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