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Application

Discovery Studio 1.0 Materials Studio 0.8074595665089669 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05582955217991714 Amorphous Cell 0.14164529492996647 Antibody 9.863878477017164E-4 Blends 0.003550996251726179 CASTEP 0.6060366936279346 CDOCKER 0.28447425527717496 CHARMm 0.4168475044387453 COMPASS 0.2521207338725587 COMPASS III 0.02170053264943776 COSMObase 0.0019727756954034327 COSMOconf 0.002959163543105149 COSMOmic 7.89110278161373E-4 COSMOperm 5.918327086210298E-4 COSMOquick 0.0023673308344841193 COSMOtherm 0.10001972775695403 Cantera 0.0 Catalyst 0.3091339514697179 Classical Simulations 1.0 Conformers 0.002959163543105149 Crystallization 0.06569343065693431 DFTB Plus 0.0051292168080489245 DMol3 0.3414874728743342 DPD 0.0061156046557506415 Discover 0.021897810218978103 Forcite 0.30459656737029 GULP 0.09863878477017163 Kinetix 3.945551390806865E-4 LUDI 0.022686920497139475 LibDock 0.10889721838626948 LigandFit 0.05405405405405406 MCSS 0.0039455513908068654 MODELER 0.3702899980272243 MesoDyn 0.003156441112645492 Mesocite 0.0033537186821858355 Mesoscale 0.011047543894259222 Morphology 0.014993095285066088 ONETEP 0.007101992503452358 Polymorph 0.004931939238508582 QMERA 3.945551390806865E-4 QSAR 0.0025646084040244622 Quantum Mechanics 0.9348984020516867 Reflex 0.04300651015979483 Reflex Plus 0.0039455513908068654 Reflex QPA 1.9727756954034326E-4 Semi-empirical 0.010061156046557506 Sorption 0.03886368119944762 Synthia 3.945551390806865E-4 TURBOMOLE 0.0011836654172420597 VAMP 0.004142828960347208 Visualization 0.9177352535016768 X-Cell 0.0017754981258630894 ZDOCK 0.032748076543696984

Year

2001 0.005356407086938607 2002 0.004120313143798929 2003 0.008240626287597858 2004 0.014833127317676144 2005 0.016481252575195716 2006 0.03378656777915121 2007 0.03584672435105068 2008 0.06180469715698393 2009 0.06963329213020189 2010 0.09435517099299547 2011 0.11454470539761022 2012 0.13967861557478367 2013 0.1858261227853317 2014 0.22620519159456118 2015 0.26452410383189123 2016 0.299958796868562 2017 0.33786567779151216 2018 0.4161516275236918 2019 0.42480428512566953 2020 0.526988051091883 2021 0.611454470539761 2022 0.6234033786567779 2023 0.8096415327564895 2024 1.0 2025 0.8582612278533168 2026 0.21549237742068397 2027 0.0

Keywords

potential 1.0 target 0.9559593869236241 docking 0.2307443574985449 analysis 0.15281640043975941 visualization 0.14098169824742934 novel 0.12009312552544785 between 0.11821768091573433 binding 0.08523572398628985 energy 0.07993274267606544 activity 0.06958546207074953 promising 0.04222983897044558 protein 0.032593933906745136 interaction 0.03097717131216452 well 0.030847830304598072 drug 0.029166397206234238 experimental 0.02489814395654142 compound 0.021923300782513096 synthesized 0.01603828493823967 chemical 0.015520920907973874 development 0.014356851839875832 inhibition 0.013063441764211344 vitro 0.0054969928215740805 including 0.00245747914376253 treatment 0.0017461036021470607 cell 0.0
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