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Application

Discovery Studio 1.0 Materials Studio 0.8216580976863753 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.052562988705473504 Amorphous Cell 0.26411815812337097 Blends 8.688097306689834E-4 CASTEP 0.27150304083405735 CDOCKER 0.1898349261511729 CHARMm 0.3032145960034752 COMPASS 0.32319721980886185 COMPASS III 0.10773240660295395 COSMObase 0.005647263249348393 COSMOconf 0.0069504778453518675 COSMOmic 0.0 COSMOperm 4.344048653344917E-4 COSMOplex 4.344048653344917E-4 COSMOquick 8.688097306689834E-4 COSMOtherm 0.06429192006950478 Catalyst 0.08688097306689835 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07211120764552563 DFTB Plus 0.003909643788010426 DMol3 0.13075586446568202 DPD 0.002172024326672459 Discover 0.0034752389226759338 Forcite 0.499131190269331 GULP 0.014335360556038228 Kinetix 0.0 LUDI 0.0030408340573414424 LibDock 0.07558644656820157 LigandFit 0.0030408340573414424 MODELER 0.28279756733275413 Mesocite 0.003909643788010426 Mesoscale 0.005647263249348393 Morphology 0.016507384882710686 ONETEP 0.0013032145960034753 Polymorph 0.002172024326672459 QMERA 0.0 Quantum Mechanics 0.39748045178105995 Reflex 0.051259774109470024 Reflex Plus 8.688097306689834E-4 Semi-empirical 0.0047784535186794095 Sorption 0.059079061685490875 Synthia 8.688097306689834E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7636837532580365 X-Cell 8.688097306689834E-4 ZDOCK 0.029105125977410946

Year

2024 0.18278497839813893 2025 1.0 2026 0.8444666001994018 2027 0.0

Keywords

target 1.0 potential 0.3289923142613151 docking 0.25939368061485907 analysis 0.23654995730145176 visualization 0.1874466268146883 between 0.12724167378309137 promising 0.09649871904355252 binding 0.09009393680614859 novel 0.0894534585824082 activity 0.05956447480785653 cell 0.05444064901793339 energy 0.05444064901793339 stability 0.037574722459436376 including 0.029035012809564473 strong 0.016652433817250213 synthesized 0.014944491887275833 performance 0.014730999146029034 effective 0.013023057216054654 therapeutic 0.01152860802732707 development 0.009607173356105893 protein 0.006831767719897523 mechanism 0.005764304013663535 strategy 0.0044833475661827495 interaction 4.269854824935952E-4 enhanced 0.0
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