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Application

Discovery Studio 1.0 Materials Studio 0.7498378097833138 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.062199807877041303 Amorphous Cell 0.1366474543707973 Antibody 7.204610951008645E-4 Blends 0.004562920268972142 CASTEP 0.5686839577329491 CDOCKER 0.28674351585014407 CHARMm 0.4409221902017291 COMPASS 0.23751200768491834 COMPASS III 0.029298751200768493 COSMObase 0.0016810758885686839 COSMOconf 0.002161383285302594 COSMOmic 7.204610951008645E-4 COSMOperm 9.606147934678194E-4 COSMOquick 0.001440922190201729 COSMOtherm 0.08789625360230548 Cantera 0.0 Catalyst 0.30667627281460136 Classical Simulations 1.0 Conformers 0.0024015369836695487 Crystallization 0.06316042267050913 DFTB Plus 0.005523535062439962 DMol3 0.32060518731988474 DPD 0.006964457252641691 Discover 0.018972142170989432 Forcite 0.3045148895292987 GULP 0.0893371757925072 Kinetix 2.4015369836695484E-4 LUDI 0.02377521613832853 LibDock 0.10614793467819404 LigandFit 0.054514889529298755 MCSS 0.004322766570605188 MODELER 0.3753602305475504 MesoDyn 0.0024015369836695487 Mesocite 0.002161383285302594 Mesoscale 0.010566762728146013 Morphology 0.01440922190201729 ONETEP 0.005283381364073006 Polymorph 0.002641690682036503 QMERA 2.4015369836695484E-4 QSAR 0.0016810758885686839 Quantum Mechanics 0.8784822286263209 Reflex 0.04442843419788665 Reflex Plus 0.0024015369836695487 Reflex QPA 0.0 Semi-empirical 0.009606147934678195 Sorption 0.03890489913544669 Synthia 0.0 TURBOMOLE 0.001440922190201729 VAMP 0.0033621517771373678 Visualization 0.9339577329490875 X-Cell 0.001440922190201729 ZDOCK 0.035782901056676274

Year

2001 0.004215456674473068 2002 0.007494145199063232 2003 0.0117096018735363 2004 0.01639344262295082 2005 0.017798594847775177 2006 0.03747072599531616 2007 0.03981264637002342 2008 0.06932084309133489 2009 0.07822014051522248 2010 0.08571428571428572 2011 0.08618266978922717 2012 0.11100702576112412 2013 0.15737704918032788 2014 0.1920374707259953 2015 0.22950819672131148 2016 0.27400468384074944 2017 0.24355971896955503 2018 0.253864168618267 2019 0.3189695550351288 2020 0.3957845433255269 2021 0.5466042154566745 2022 0.652927400468384 2023 0.7334894613583138 2024 0.9892271662763467 2025 1.0 2026 0.2501170960187354 2027 0.0

Keywords

potential 1.0 target 0.954968694814577 docking 0.23928399422058116 analysis 0.16086049125060203 visualization 0.14328142558998233 novel 0.12088617755659015 between 0.11269866752287687 binding 0.09696580510515332 activity 0.07232300529780061 energy 0.06822925028094397 promising 0.04013485310643763 protein 0.03555947985230374 drug 0.02929844276769947 interaction 0.02608765451918446 well 0.020468775084283193 experimental 0.017980414191684058 compound 0.01765933536683256 development 0.014769625943169048 vitro 0.009953443570396533 synthesized 0.009712634451757907 chemical 0.007144003852945898 inhibition 0.004976721785198267 stability 0.001846203242896131 including 0.0013645850056188795 treatment 0.0
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