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Application

Discovery Studio 1.0 Materials Studio 0.2559153175591532 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.11917098445595854 Amorphous Cell 0.07124352331606218 CASTEP 0.02072538860103627 CDOCKER 0.39766839378238344 CHARMm 0.5634715025906736 COMPASS 0.3160621761658031 COMPASS III 0.006476683937823834 COSMOperm 0.0 COSMOtherm 0.011658031088082901 Catalyst 0.5310880829015544 Classical Simulations 1.0 Conformers 0.0025906735751295338 Crystallization 0.012953367875647668 DFTB Plus 0.0025906735751295338 DMol3 0.12823834196891193 Discover 0.029792746113989636 Forcite 0.24481865284974094 GULP 0.0012953367875647669 LUDI 0.029792746113989636 LibDock 0.11528497409326424 LigandFit 0.11787564766839378 MCSS 0.0025906735751295338 MODELER 0.4572538860103627 Morphology 0.0025906735751295338 ONETEP 0.0012953367875647669 QSAR 0.0051813471502590676 Quantum Mechanics 0.15025906735751296 Reflex 0.007772020725388601 Reflex Plus 0.0 Semi-empirical 0.023316062176165803 Sorption 0.006476683937823834 VAMP 0.019430051813471502 Visualization 0.75 X-Cell 0.0025906735751295338 ZDOCK 0.03238341968911917

Year

2002 0.0 2003 0.0 2004 0.0 2005 0.0035587188612099642 2006 0.017793594306049824 2007 0.014234875444839857 2008 0.08185053380782918 2009 0.11387900355871886 2010 0.19217081850533807 2011 0.05338078291814947 2012 0.046263345195729534 2013 0.47686832740213525 2014 0.4697508896797153 2015 0.4875444839857651 2016 0.5693950177935944 2017 0.701067615658363 2018 0.7686832740213523 2019 1.0 2020 0.33807829181494664 2021 0.47686832740213525 2022 0.4377224199288256 2023 0.5373665480427047 2024 0.13523131672597866 2025 0.25622775800711745 2026 0.021352313167259787

Keywords

inhibition 1.0 target 0.9630512514898689 docking 0.3367103694874851 potential 0.21930870083432658 activity 0.18891537544696066 novel 0.16507747318235996 inhibitor 0.16090584028605484 visualization 0.1263408820023838 binding 0.12038140643623362 compound 0.1030989272943981 potent 0.09177592371871275 synthesized 0.08104886769964244 analysis 0.0768772348033373 vitro 0.06615017878426699 synthesis 0.05542312276519666 inhibitory 0.054231227651966626 enzyme 0.04052443384982122 between 0.03694874851013111 catalyst 0.028605482717520857 human 0.02443384982121573 protein 0.020858164481525627 medicinal 0.016090584028605484 drug 0.00834326579261025 interaction 0.0017878426698450535 chemical 0.0
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