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Application

Discovery Studio 0.6659330985915493 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06829539144919489 Amorphous Cell 0.3470294280955025 Blends 0.002220988339811216 CASTEP 0.3187118267629095 CDOCKER 0.11327040533037201 CHARMm 0.1960022209883398 COMPASS 0.40033314825097166 COMPASS III 0.10272071071626875 COSMObase 5.55247084952804E-4 COSMOconf 0.003331482509716824 COSMOmic 0.0 COSMOperm 5.55247084952804E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.05385896724042199 Catalyst 0.042754025541365905 Classical Simulations 1.0 Crystallization 0.051637978900610775 DFTB Plus 0.00277623542476402 DMol3 0.15769017212659633 DPD 0.002220988339811216 Discover 0.004441976679622432 Forcite 0.5846751804553026 GULP 0.02609661299278179 LUDI 0.001110494169905608 LibDock 0.049416990560799554 LigandFit 5.55247084952804E-4 MODELER 0.20377568017767908 MesoDyn 0.001110494169905608 Mesocite 0.002220988339811216 Mesoscale 0.006107717934480844 Modules 0.0 Morphology 0.01776790671848973 ONETEP 0.001110494169905608 Polymorph 5.55247084952804E-4 QMERA 5.55247084952804E-4 QSAR 0.0 Quantum Mechanics 0.4636313159355913 Reflex 0.031093836757357024 Reflex Plus 0.0 Semi-empirical 0.003886729594669628 Sorption 0.05885619100499723 Synthia 5.55247084952804E-4 Visualization 0.4858411993337035 X-Cell 0.0 ZDOCK 0.0277623542476402

Year

2023 0.0 2024 0.3783783783783784 2025 1.0 2026 0.5566619250829777 2027 0.0

Keywords

between 1.0 target 0.9205714285714286 potential 0.24914285714285714 analysis 0.21342857142857144 docking 0.17314285714285715 interaction 0.17114285714285715 energy 0.11771428571428572 cell 0.088 visualization 0.08457142857142858 performance 0.08342857142857144 binding 0.07314285714285715 mechanism 0.057428571428571426 stability 0.056857142857142856 novel 0.054285714285714284 experimental 0.053142857142857144 strong 0.03628571428571428 promising 0.031714285714285716 enhanced 0.02942857142857143 amorphous 0.017714285714285714 effective 0.011428571428571429 including 0.008 surface 0.004 activity 0.0025714285714285713 development 0.0017142857142857142 role 0.0
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