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Application

Discovery Studio 1.0 Materials Studio 0.7374946558358273 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06627680311890838 Amorphous Cell 0.08187134502923976 Blends 0.0011695906432748538 CASTEP 0.43742690058479533 CDOCKER 0.3037037037037037 CHARMm 0.34346978557504876 COMPASS 0.20428849902534113 COMPASS III 0.018323586744639377 COSMObase 0.0011695906432748538 COSMOconf 7.797270955165692E-4 COSMOperm 7.797270955165692E-4 COSMOplex 0.0 COSMOquick 3.898635477582846E-4 COSMOtherm 0.04132553606237817 Catalyst 0.3617933723196881 Classical Simulations 0.8604288499025341 Conformers 0.005458089668615985 Crystallization 0.1419103313840156 DFTB Plus 0.007017543859649123 DMol3 0.32748538011695905 DPD 0.0050682261208577 Discover 0.01871345029239766 Forcite 0.28460038986354774 GULP 0.058869395711500974 LUDI 0.012085769980506823 LibDock 0.07719298245614035 LigandFit 0.03898635477582846 MCSS 0.0035087719298245615 MODELER 0.22651072124756336 MesoDyn 0.003898635477582846 Mesocite 0.0023391812865497076 Mesoscale 0.01091617933723197 Morphology 0.015984405458089667 Polymorph 0.0031189083820662767 QMERA 7.797270955165692E-4 QSAR 0.0035087719298245615 Quantum Mechanics 0.749317738791423 Reflex 0.11461988304093568 Reflex Plus 0.007797270955165692 Reflex QPA 3.898635477582846E-4 Semi-empirical 0.015594541910331383 Sorption 0.0304093567251462 Synthia 7.797270955165692E-4 TURBOMOLE 7.797270955165692E-4 VAMP 0.007017543859649123 Visualization 1.0 X-Cell 0.008576998050682261 ZDOCK 0.007407407407407408

Year

2003 0.0032679738562091504 2004 0.0196078431372549 2005 0.017429193899782137 2006 0.03594771241830065 2007 0.054466230936819175 2008 0.06100217864923747 2009 0.08169934640522876 2010 0.11002178649237472 2011 0.11655773420479303 2012 0.1394335511982571 2013 0.31263616557734203 2014 0.369281045751634 2015 0.4782135076252723 2016 0.4400871459694989 2017 0.5555555555555556 2018 0.5849673202614379 2019 0.6285403050108932 2020 0.7211328976034859 2021 0.5860566448801743 2022 0.8605664488017429 2023 0.971677559912854 2024 1.0 2025 0.8278867102396514 2026 0.19934640522875818 2027 0.0

Keywords

synthesis 1.0 target 0.9686258391560488 synthesized 0.3867653103164817 docking 0.253733388135361 novel 0.2335936429647897 visualization 0.19550623373064804 potential 0.17399643786820113 compound 0.16235100698725852 design 0.15262364707494178 activity 0.14207425674749966 analysis 0.08028497054391012 between 0.06754349910946705 potent 0.06178928620358953 binding 0.0530209617755857 inhibition 0.03986847513357994 vitro 0.038635429510891904 promising 0.037676394026578984 designed 0.03466228250445266 chemical 0.02260583641594739 active 0.019865735032196193 catalyst 0.018906699547883273 experimental 0.014933552541444033 well 0.013015481572818195 medicinal 0.005891217975065077 cell 0.0
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