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Application

Discovery Studio 0.9602127240496356 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.044989775051124746 Amorphous Cell 0.12065439672801637 Antibody 0.0011685655857434998 Blends 0.004674262342973999 CASTEP 0.6345311130587205 CDOCKER 0.2626351153958516 CHARMm 0.36225533158048495 COMPASS 0.22816243061641836 COMPASS III 0.010809231668127374 COSMObase 8.764241893076249E-4 COSMOconf 0.002044989775051125 COSMOmic 8.764241893076249E-4 COSMOperm 2.9214139643587495E-4 COSMOquick 0.0026292725679228747 COSMOtherm 0.10078878177037687 Cantera 0.0 Catalyst 0.3184341221151037 Classical Simulations 0.9249196611159801 Conformers 0.0032135553607946245 Crystallization 0.06339468302658487 DFTB Plus 0.004674262342973999 DMol3 0.37773882559158634 DPD 0.007595676307332749 Discover 0.026877008472100495 Forcite 0.2614665498101081 GULP 0.12299152789950336 LUDI 0.026584867075664622 LibDock 0.08939526730937773 LigandFit 0.06397896581945661 MCSS 0.0052585451358457495 MODELER 0.3654688869412796 MesoDyn 0.0035056967572304996 Mesocite 0.00292141396435875 Mesoscale 0.012562080046742623 Morphology 0.015775635407537247 ONETEP 0.0081799591002045 Polymorph 0.00408997955010225 QMERA 0.0 QSAR 0.0032135553607946245 Quantum Mechanics 1.0 Reflex 0.040315512708150744 Reflex Plus 0.0043821209465381246 Reflex QPA 2.9214139643587495E-4 Semi-empirical 0.010224948875255624 Sorption 0.03710195734735612 Synthia 2.9214139643587495E-4 TURBOMOLE 0.0017528483786152498 VAMP 0.004966403739409875 Visualization 0.6491381828805142 X-Cell 0.0017528483786152498 ZDOCK 0.029506281040023372

Year

2002 0.0 2003 0.01008249312557287 2004 0.03299725022914757 2005 0.03666361136571952 2006 0.07516040329972502 2007 0.07974335472043996 2008 0.13748854262144822 2009 0.15490375802016498 2010 0.1998166819431714 2011 0.19431714023831348 2012 0.22089825847846012 2013 0.3712190650779102 2014 0.5032080659945004 2015 0.5884509624197983 2016 0.6672777268560953 2017 0.7516040329972502 2018 0.8414298808432631 2019 0.7231897341888176 2020 1.0 2021 0.8304307974335472 2022 0.7772685609532539 2023 0.9835013748854262 2024 0.5719523373052245 2025 0.25939505041246563 2026 0.054995417048579284 2027 0.0

Keywords

potential 1.0 target 0.9580484773151026 docking 0.17101719494510048 between 0.13569504868448312 novel 0.12378288792210483 energy 0.11622125543816035 analysis 0.11487466335197845 visualization 0.09312202195980941 binding 0.07209446861404599 activity 0.07199088460741661 well 0.06339341205717837 experimental 0.05707478765278641 chemical 0.045266210897037494 interaction 0.038326082452869274 drug 0.029314273876113527 protein 0.029107105862854775 compound 0.02869276983633727 synthesized 0.027346177750155375 promising 0.024135073544644708 development 0.018955873213175885 design 0.018645121193287758 inhibition 0.015330432981147711 cell 0.012326496788895795 synthesis 0.009944064636420136 catalyst 0.0
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