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Application

Discovery Studio 0.825 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06772289530910221 Amorphous Cell 0.29263746505125815 Blends 0.0015532774153463808 CASTEP 0.3569431500465983 CDOCKER 0.15222118670394533 CHARMm 0.24168996582789687 COMPASS 0.3634669151910531 COMPASS III 0.09102205653929792 COSMObase 0.003727865796831314 COSMOconf 0.005591798695246971 COSMOperm 0.0 COSMOquick 0.0021745883814849334 COSMOtherm 0.06679092885989438 Catalyst 0.06710158434296365 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07207207207207207 DFTB Plus 0.007145076110593352 DMol3 0.15936626281453867 DPD 0.0027958993476234857 Discover 0.001863932898415657 Forcite 0.561354457906182 GULP 0.021435228331780055 Kinetix 0.0 LUDI 0.003417210313762038 LibDock 0.06337371854613234 LigandFit 0.0031065548306927616 MODELER 0.23547685616651134 MesoDyn 0.0012426219322771047 Mesocite 0.0021745883814849334 Mesoscale 0.006213109661385523 Modules 0.0 Morphology 0.016464740602671637 ONETEP 6.213109661385523E-4 Polymorph 0.0015532774153463808 QSAR 0.0012426219322771047 Quantum Mechanics 0.5066790928859894 Reflex 0.05187946567256912 Reflex Plus 0.0015532774153463808 Semi-empirical 0.008698353525939733 Sorption 0.051568810189499846 Synthia 9.319664492078285E-4 TURBOMOLE 3.1065548306927616E-4 VAMP 0.0012426219322771047 Visualization 0.6188257222739981 X-Cell 0.001863932898415657 ZDOCK 0.02516309412861137

Year

2025 0.0

Keywords

target 1.0 potential 0.30216349644257295 analysis 0.1980543052127196 docking 0.18527660810222157 between 0.15914040946711194 visualization 0.13561783069551328 novel 0.09786554377813271 energy 0.09757514157107594 promising 0.08842747204878756 cell 0.07332655728183535 binding 0.06868012196892696 stability 0.050384782924350224 performance 0.05023958182082184 including 0.043415129954987655 activity 0.039785102366777986 experimental 0.029475824016262524 interaction 0.02511979091041092 development 0.024393785392768985 effective 0.024103383185712212 enhanced 0.021199361115144474 strong 0.020618556701030927 synthesized 0.018440540148105127 mechanism 0.016262523595179323 synthesis 0.0026136198635109626 therapeutic 0.0
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