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Application

Discovery Studio 1.0 Materials Studio 0.5927329469460544 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06473988439306358 Amorphous Cell 0.0789980732177264 Blends 3.853564547206166E-4 CASTEP 0.31483622350674373 CDOCKER 0.2373795761078998 CHARMm 0.30366088631984584 COMPASS 0.17071290944123313 COMPASS III 0.02466281310211946 COSMObase 3.853564547206166E-4 COSMOconf 0.0 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.03391136801541426 Catalyst 0.3229287090558767 Classical Simulations 0.7333333333333333 Conformers 0.002697495183044316 Crystallization 0.11560693641618497 DFTB Plus 0.005009633911368015 DMol3 0.2327552986512524 DPD 0.0019267822736030828 Discover 0.01001926782273603 Forcite 0.2543352601156069 GULP 0.037379576107899805 LUDI 0.01001926782273603 LibDock 0.07283236994219654 LigandFit 0.02581888246628131 MCSS 0.003468208092485549 MODELER 0.1957610789980732 MesoDyn 0.004624277456647399 Mesocite 7.707129094412332E-4 Mesoscale 0.007707129094412331 Morphology 0.013872832369942197 Polymorph 0.002697495183044316 QMERA 3.853564547206166E-4 QSAR 0.0030828516377649326 Quantum Mechanics 0.5341040462427745 Reflex 0.09402697495183045 Reflex Plus 0.006165703275529865 Semi-empirical 0.010404624277456647 Sorption 0.02581888246628131 Synthia 3.853564547206166E-4 TURBOMOLE 0.0 VAMP 0.004238921001926782 Visualization 1.0 X-Cell 0.004624277456647399 ZDOCK 0.008477842003853564

Year

2001 7.423904974016332E-4 2002 0.0 2003 0.002969561989606533 2004 0.0066815144766146995 2005 0.004454342984409799 2006 0.012620638455827766 2007 0.020786933927245732 2008 0.025983667409057165 2009 0.030438010393466965 2010 0.0378619153674833 2011 0.07052709725315516 2012 0.09651076466221233 2013 0.1276911655530809 2014 0.11432813659985153 2015 0.16481069042316257 2016 0.14179658500371195 2017 0.18337045285820341 2018 0.23088344469190794 2019 0.26651818856718634 2020 0.2947290274684484 2021 0.34075723830734966 2022 0.4528582034149963 2023 0.6674090571640683 2024 0.9821826280623608 2025 1.0 2026 0.21158129175946547 2027 0.0

Keywords

synthesis 1.0 target 0.9687794163790399 synthesized 0.394728584876059 docking 0.32052086601819896 visualization 0.24411672419203012 novel 0.24286162535299655 potential 0.220897395669909 compound 0.1735174144963916 design 0.15688735487919675 activity 0.1491998744901161 analysis 0.10856604957640414 binding 0.07561970505177283 between 0.06463759021022905 promising 0.06432381550047066 potent 0.0624411672419203 vitro 0.057263884530906806 inhibition 0.04785064323815501 designed 0.02541575149042987 active 0.017571383746470035 catalyst 0.016159397552557263 chemical 0.010354565422026984 experimental 0.005334170065892689 cell 0.005020395356134295 well 0.003922183871979918 characterization 0.0
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