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Application

Discovery Studio 0.8653763440860215 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.11562736682655896 Amorphous Cell 0.14466043928300934 Antibody 0.0 Blends 0.003029537995455693 CASTEP 0.6311537490532694 CDOCKER 0.25296642262055036 CHARMm 0.2963898005554153 COMPASS 0.33526887149709667 COMPASS III 0.02827568795758647 COSMObase 0.0 COSMOconf 5.049229992426155E-4 COSMOmic 2.5246149962130775E-4 COSMOperm 2.5246149962130775E-4 COSMOquick 5.049229992426155E-4 COSMOtherm 0.03736430194395355 Catalyst 0.29462257005806614 Classical Simulations 1.0 Conformers 0.0015147689977278464 Crystallization 0.17520828073718758 DFTB Plus 0.006311537490532693 DMol3 0.3168391820247412 DPD 0.007321383489017925 Discover 0.027518303458722543 Equilibria 0.0 Forcite 0.42388285786417573 GULP 0.03231507195152739 LUDI 0.009341075485988387 LibDock 0.062105528906841706 LigandFit 0.0292855339560717 MCSS 0.0035344609946983086 MODELER 0.15122443827316334 MesoDyn 0.0035344609946983086 Mesocite 0.0037869224943196163 Mesoscale 0.01338045947992931 Morphology 0.02120676596818985 ONETEP 2.5246149962130775E-4 Polymorph 0.006059075990911386 QMERA 7.573844988639232E-4 QSAR 0.002777076495834385 Quantum Mechanics 0.9315829336026256 Reflex 0.14087351678868973 Reflex Plus 0.01009845998485231 Semi-empirical 0.01464276697803585 Sorption 0.05049229992426155 Synthia 0.0025246149962130774 TURBOMOLE 5.049229992426155E-4 VAMP 0.007068921989396617 Visualization 0.9093663216359505 X-Cell 0.0053016914920474625 ZDOCK 0.006563998990154002

Year

2001 0.0 2002 0.0016863406408094434 2003 0.0016863406408094434 2004 0.007307476110174255 2005 0.007869589657110737 2006 0.016301292861157952 2007 0.01854974704890388 2008 0.03204047217537943 2009 0.050590219224283306 2010 0.06520517144463181 2011 0.10342889263631254 2012 0.13603147835862844 2013 0.18268690275435637 2014 0.2175379426644182 2015 0.2776840921866217 2016 0.26700393479482853 2017 0.33108487914558743 2018 0.3946037099494098 2019 0.49128724002248453 2020 0.5098369870713885 2021 0.6003372681281619 2022 0.702079820123665 2023 0.8487914558740866 2024 1.0 2025 0.9173693086003373 2026 0.3456998313659359 2027 0.0

Keywords

synthesized 1.0 target 0.9663320062316081 synthesis 0.3071663493162541 novel 0.21750043275056258 docking 0.20936472217413882 potential 0.1694651203046564 visualization 0.14782759217586983 compound 0.14514453868790028 analysis 0.09433962264150944 activity 0.09295482084126709 between 0.09027176735329756 designed 0.059113726847844904 design 0.05236281807166349 experimental 0.047602561883330445 promising 0.04336160637008828 binding 0.04240955513242167 potent 0.03202354163060412 inhibition 0.028388436904967975 vitro 0.021031677341180544 energy 0.019300675090877618 well 0.011338064739484162 cell 0.007789510126363164 x-ray 0.005539207200969361 chemical 0.004500605850787606 active 0.0
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