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Application

Discovery Studio 1.0 Materials Studio 0.7700837851158207 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05738816086760054 Amorphous Cell 0.13759602349751468 Antibody 6.778129236330773E-4 Blends 0.002937189335743335 CASTEP 0.5899231812019883 CDOCKER 0.2788070492544058 CHARMm 0.42679620424762765 COMPASS 0.24604609127880706 COMPASS III 0.0219159511974695 COSMObase 0.002033438770899232 COSMOconf 0.002937189335743335 COSMOmic 6.778129236330773E-4 COSMOperm 4.5187528242205153E-4 COSMOquick 0.0022593764121102574 COSMOtherm 0.09624943515589697 Catalyst 0.32331676457297787 Classical Simulations 1.0 Conformers 0.0024853140533212833 Crystallization 0.06303660189787619 DFTB Plus 0.004066877541798464 DMol3 0.3296430185268866 DPD 0.004518752824220515 Discover 0.021012200632625395 Forcite 0.2998192498870312 GULP 0.09534568459105287 Kinetix 0.0 LUDI 0.023723452327157703 LibDock 0.10777225485765929 LigandFit 0.05851784907365567 MCSS 0.0031631269769543608 MODELER 0.3737008585630366 MesoDyn 0.002937189335743335 Mesocite 0.0031631269769543608 Mesoscale 0.009715318572074107 Morphology 0.01333032083145052 ONETEP 0.006552191595119747 Polymorph 0.004744690465431541 QMERA 0.0 QSAR 0.0018075011296882061 Quantum Mechanics 0.9073655671034795 Reflex 0.041798463624039765 Reflex Plus 0.0036150022593764122 Reflex QPA 0.0 Semi-empirical 0.009263443289652055 Sorption 0.03637596023497515 Synthia 2.2593764121102577E-4 TURBOMOLE 0.0011296882060551287 VAMP 0.00429281518300949 Visualization 0.9349299593312246 X-Cell 0.0013556258472661546 ZDOCK 0.03298689561680976

Year

2001 0.005917159763313609 2002 0.004551661356395084 2003 0.009103322712790168 2004 0.016385980883022302 2005 0.018206645425580335 2006 0.03732362312243969 2007 0.03959945380063723 2008 0.06827492034592626 2009 0.07692307692307693 2010 0.10423304506144743 2011 0.12653618570778333 2012 0.15430131998179336 2013 0.2052799271734183 2014 0.2171142467000455 2015 0.22530723714155668 2016 0.2658170232134729 2017 0.3063268092853892 2018 0.34820209376422395 2019 0.35366408739189803 2020 0.39326354119253526 2021 0.5248065543923532 2022 0.6781975421028675 2023 0.7619481110605371 2024 1.0 2025 0.9458352298588985 2026 0.2380518889394629 2027 0.0

Keywords

potential 1.0 target 0.9544948407690594 docking 0.24103630020043054 analysis 0.1607156113131913 visualization 0.14653700541904832 novel 0.11966446440501818 between 0.11706629055007052 binding 0.08967411476505086 energy 0.0760893771806102 activity 0.07081879593200208 promising 0.04446588968896147 protein 0.035706332120852204 interaction 0.032588523494915006 drug 0.031029619181946404 well 0.027689109939870834 experimental 0.02197312745898597 compound 0.021676193304134807 synthesized 0.016034444361962736 development 0.015514809590973202 inhibition 0.014624007126419716 chemical 0.01187736619404647 vitro 0.007423353871279044 including 0.005864449558310445 treatment 0.002152772622670923 cell 0.0
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