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Application

Discovery Studio 1.0 Materials Studio 0.77311868214152 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04712041884816754 Amorphous Cell 0.2617801047120419 Blends 0.0010471204188481676 CASTEP 0.25968586387434556 CDOCKER 0.193717277486911 CHARMm 0.31099476439790574 COMPASS 0.3157068062827225 COMPASS III 0.11413612565445026 COSMObase 0.004188481675392671 COSMOconf 0.007853403141361256 COSMOmic 0.0 COSMOperm 5.235602094240838E-4 COSMOplex 5.235602094240838E-4 COSMOtherm 0.06230366492146597 Catalyst 0.08324607329842931 Classical Simulations 1.0 Conformers 5.235602094240838E-4 Crystallization 0.07068062827225131 DFTB Plus 0.0036649214659685864 DMol3 0.1193717277486911 DPD 0.0015706806282722514 Discover 0.0031413612565445027 Forcite 0.49162303664921464 GULP 0.011518324607329843 Kinetix 0.0 LUDI 0.0031413612565445027 LibDock 0.07905759162303665 LigandFit 0.002617801047120419 MODELER 0.29476439790575915 Mesocite 0.004188481675392671 Mesoscale 0.005235602094240838 Morphology 0.015706806282722512 ONETEP 0.0010471204188481676 Polymorph 0.0020942408376963353 Quantum Mechanics 0.374869109947644 Reflex 0.050785340314136125 Reflex Plus 0.0 Semi-empirical 0.004188481675392671 Sorption 0.060209424083769635 Synthia 0.0010471204188481676 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7863874345549738 X-Cell 5.235602094240838E-4 ZDOCK 0.031413612565445025

Year

2024 0.06656406310119277 2025 1.0 2026 0.8864948056944979 2027 0.0

Keywords

target 1.0 potential 0.34409428644632334 docking 0.2736356648731745 analysis 0.23648475531642327 visualization 0.19882141942095824 between 0.1245196003074558 binding 0.10453497309761722 promising 0.0988982833717653 novel 0.09710479118626697 activity 0.06789648987957982 cell 0.05124263387138099 energy 0.04996156802459646 stability 0.04201895977453241 including 0.0361260568793236 strong 0.02997694081475788 therapeutic 0.02434025108890597 performance 0.019472200871124775 effective 0.01870356136305406 development 0.01614142966948501 mechanism 0.012810658467845248 protein 0.011529592621060722 strategy 0.011273379451703817 synthesized 0.009992313604919293 interaction 0.006661542403279528 enhanced 0.0
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