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Application

Discovery Studio 0.8020866773675762 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.11311281748375665 Amorphous Cell 0.14294152392203188 Antibody 0.0 Blends 0.0032486709982279976 CASTEP 0.6727702303603071 CDOCKER 0.25575900767867693 CHARMm 0.2844063792085056 COMPASS 0.33697578263437683 COMPASS III 0.02598936798582398 COSMObase 0.0 COSMOconf 2.9533372711163615E-4 COSMOperm 0.0 COSMOquick 2.9533372711163615E-4 COSMOtherm 0.03691671588895452 Catalyst 0.28470171293561725 Classical Simulations 0.996751329001772 Conformers 0.002067336089781453 Crystallization 0.1795629060838748 DFTB Plus 0.006497341996455995 DMol3 0.34376845835794445 DPD 0.008564678086237449 Discover 0.03071470761961016 Equilibria 0.0 Forcite 0.4258712344949793 GULP 0.03544004725339634 LUDI 0.009746012994683993 LibDock 0.06142941523922032 LigandFit 0.031010041346721796 MCSS 0.004134672179562906 MODELER 0.15268753691671588 MesoDyn 0.004134672179562906 Mesocite 0.004430005906674543 Mesoscale 0.015652687536916714 Morphology 0.02067336089781453 ONETEP 2.9533372711163615E-4 Polymorph 0.0062020082693443595 QMERA 8.860011813349084E-4 QSAR 0.0026580035440047253 Quantum Mechanics 1.0 Reflex 0.14500886001181335 Reflex Plus 0.011222681630242174 Semi-empirical 0.015652687536916714 Sorption 0.051683402244536325 Synthia 0.0029533372711163615 TURBOMOLE 2.9533372711163615E-4 VAMP 0.00767867690490254 Visualization 0.880685174246899 X-Cell 0.005020673360897815 ZDOCK 0.006497341996455995

Year

2001 0.0 2002 0.0014503263234227702 2003 0.0 2004 0.010877447425670777 2005 0.011602610587382161 2006 0.022480058013052938 2007 0.025380710659898477 2008 0.04278462654097172 2009 0.06671501087744743 2010 0.08049311094996374 2011 0.1116751269035533 2012 0.14285714285714285 2013 0.22770123277737492 2014 0.2820884699057288 2015 0.359680928208847 2016 0.34590282813633066 2017 0.42857142857142855 2018 0.5105148658448151 2019 0.6345177664974619 2020 0.6424945612762871 2021 0.659173313995649 2022 0.9064539521392313 2023 0.9354604786076868 2024 1.0 2025 0.7222625090645395 2026 0.22987672226250908 2027 0.0

Keywords

synthesized 1.0 target 0.9696605587263443 synthesis 0.3048963652748573 novel 0.2099729648543106 docking 0.1906478421948533 potential 0.15460098127565836 compound 0.13978171623110042 visualization 0.13777911284670072 between 0.09312105737458697 analysis 0.08991689195954741 activity 0.08691298688294784 designed 0.058375888655251826 experimental 0.05236807850205267 design 0.0485631320716932 promising 0.03444477821167518 binding 0.03404425753479524 potent 0.028036447381596073 energy 0.02393111044357665 inhibition 0.02242915790527686 well 0.02092720536697707 vitro 0.015019525382997898 x-ray 0.014318614198457995 chemical 0.011314709121858417 cell 0.005507159307099229 active 0.0
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