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Application

Discovery Studio 0.7559218950064021 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07586533902323377 Amorphous Cell 0.28117591275486015 Blends 0.003319108582266477 CASTEP 0.49359886201991465 CDOCKER 0.14129919393077287 CHARMm 0.22664770033191087 COMPASS 0.42508297771455666 COMPASS III 0.046704599336178286 COSMObase 9.48316737790422E-4 COSMOconf 7.112375533428165E-4 COSMOmic 2.370791844476055E-4 COSMOperm 0.001422475106685633 COSMOplex 2.370791844476055E-4 COSMOquick 0.001422475106685633 COSMOtherm 0.06330014224751067 Cantera 0.0 Catalyst 0.0953058321479374 Classical Simulations 1.0 Conformers 0.001422475106685633 Crystallization 0.08819345661450925 DFTB Plus 0.007823613086770981 DMol3 0.2321005215742058 DPD 0.0045045045045045045 Discover 0.005926979611190137 Forcite 0.5455192034139402 GULP 0.036747273589378855 Kinetix 0.0 LUDI 0.002370791844476055 LibDock 0.0602181128496918 LigandFit 0.004267425320056899 MCSS 7.112375533428165E-4 MODELER 0.21408250355618777 MesoDyn 0.003319108582266477 Mesocite 0.005689900426742532 Mesoscale 0.011379800853485065 Morphology 0.01849217638691323 ONETEP 0.0011853959222380276 Polymorph 0.001896633475580844 QMERA 2.370791844476055E-4 QSAR 0.0021337126600284497 Quantum Mechanics 0.7110004741583689 Reflex 0.06780464675201517 Semi-empirical 0.011142721669037459 Sorption 0.050497866287339974 Synthia 0.001896633475580844 TURBOMOLE 7.112375533428165E-4 VAMP 0.0026078710289236607 Visualization 0.6853959222380275 X-Cell 4.74158368895211E-4 ZDOCK 0.02370791844476055

Year

2024 0.0

Keywords

target 1.0 potential 0.25458576899818586 analysis 0.17315057448095142 between 0.1701269905261036 docking 0.16720419270308406 visualization 0.13585970570449507 energy 0.09866962305986696 novel 0.08919572666801048 cell 0.05049385204595848 binding 0.04414432574077807 interaction 0.042934892158838944 experimental 0.04041523886313243 promising 0.03779479943559766 activity 0.035678290667204196 stability 0.03033662568030639 effective 0.021467446079419472 mechanism 0.02086272928844991 synthesized 0.020761943156621648 development 0.009675468655513001 chemical 0.00957468252368474 including 0.007256601491634751 performance 0.006752670832493449 synthesis 0.004938520459584761 well 0.003729086877645636 higher 0.0
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