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Application

Discovery Studio 1.0 Materials Studio 0.8587102552619794 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05550581915846016 Amorphous Cell 0.26439868695911667 Blends 0.002387347060578932 CASTEP 0.288272157564906 CDOCKER 0.18919725455088032 CHARMm 0.2987168009549388 COMPASS 0.32408236347359 COMPASS III 0.10743061772605192 COSMObase 0.004476275738585497 COSMOconf 0.004774694121157864 COSMOmic 0.0 COSMOperm 2.984183825723665E-4 COSMOplex 2.984183825723665E-4 COSMOquick 5.96836765144733E-4 COSMOtherm 0.06147418680990749 Catalyst 0.0844524022679797 Classical Simulations 1.0 Conformers 5.96836765144733E-4 Crystallization 0.07281408534765742 DFTB Plus 0.0035810205908683975 DMol3 0.13846612951357803 DPD 0.0029841838257236644 Discover 0.003879438973440764 Forcite 0.5031333930170099 GULP 0.01521933751119069 Kinetix 2.984183825723665E-4 LUDI 0.0041778573560131305 LibDock 0.07729036108624292 LigandFit 0.004476275738585497 MODELER 0.27782751417487317 Mesocite 0.0035810205908683975 Mesoscale 0.005968367651447329 Modules 0.0 Morphology 0.015816174276335422 ONETEP 0.001193673530289466 Polymorph 0.002387347060578932 QMERA 2.984183825723665E-4 QSAR 0.0 Quantum Mechanics 0.42017308266189196 Reflex 0.052820053715308866 Reflex Plus 8.952551477170994E-4 Semi-empirical 0.004774694121157864 Sorption 0.05729632945389436 Synthia 8.952551477170994E-4 TURBOMOLE 0.0 VAMP 2.984183825723665E-4 Visualization 0.7457475380483438 X-Cell 0.0014920919128618322 ZDOCK 0.03043867502238138

Year

2024 0.2808641975308642 2025 1.0 2026 0.8359449192782527 2027 0.0

Keywords

target 1.0 potential 0.3290030652459495 docking 0.2503284192088746 analysis 0.2333965844402277 visualization 0.17982776237045686 between 0.13574660633484162 novel 0.0935629835060575 promising 0.09312509122755802 binding 0.08611881477156619 activity 0.05663406801926726 cell 0.05517442709093563 energy 0.054882498905269306 stability 0.03707487957962341 performance 0.025105823967304042 including 0.02481389578163772 strong 0.01824551160414538 synthesized 0.015618157933148446 development 0.01488833746898263 effective 0.014596409283316304 mechanism 0.010947306962487227 protein 0.007590132827324478 interaction 0.006422420084659174 enhanced 0.0043789227849948915 therapeutic 0.0016056050211647934 strategy 0.0
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