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Application

Discovery Studio 1.0 Materials Studio 0.9654783393501805 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06 Amorphous Cell 0.28194444444444444 Blends 0.0019444444444444444 CASTEP 0.3175 CDOCKER 0.17027777777777778 CHARMm 0.2772222222222222 COMPASS 0.33416666666666667 COMPASS III 0.1063888888888889 COSMObase 0.005 COSMOconf 0.007222222222222222 COSMOmic 0.0 COSMOperm 5.555555555555556E-4 COSMOplex 2.777777777777778E-4 COSMOquick 0.001388888888888889 COSMOtherm 0.06583333333333333 Catalyst 0.07583333333333334 Classical Simulations 1.0 Conformers 2.777777777777778E-4 Crystallization 0.07166666666666667 DFTB Plus 0.0022222222222222222 DMol3 0.14583333333333334 DPD 0.0011111111111111111 Discover 0.0044444444444444444 Forcite 0.5177777777777778 GULP 0.017222222222222222 Kinetix 0.0 LUDI 0.0044444444444444444 LibDock 0.07194444444444445 LigandFit 0.0038888888888888888 MCSS 2.777777777777778E-4 MODELER 0.26472222222222225 MesoDyn 5.555555555555556E-4 Mesocite 0.0030555555555555557 Mesoscale 0.004722222222222222 Morphology 0.016944444444444446 ONETEP 5.555555555555556E-4 Polymorph 0.0016666666666666668 QMERA 2.777777777777778E-4 QSAR 5.555555555555556E-4 Quantum Mechanics 0.45416666666666666 Reflex 0.052222222222222225 Reflex Plus 0.0 Semi-empirical 0.004166666666666667 Sorption 0.05694444444444444 Synthia 8.333333333333334E-4 TURBOMOLE 0.0 VAMP 0.0011111111111111111 Visualization 0.7002777777777778 X-Cell 0.0011111111111111111 ZDOCK 0.03

Year

2024 0.26456798392498326 2025 1.0 2026 0.8403661531591873 2027 0.0

Keywords

target 1.0 potential 0.31980115990057995 docking 0.2315658657829329 analysis 0.22190002761668048 visualization 0.16542391604529136 between 0.14194973764153548 novel 0.095967964650649 promising 0.09127312896989782 binding 0.08354045843689588 energy 0.07152720243026787 cell 0.06172328086164043 activity 0.04763877381938691 stability 0.0432201049433858 performance 0.032587682960508145 including 0.026650096658381663 strong 0.022783761391880698 development 0.015603424468378901 effective 0.015603424468378901 mechanism 0.012013256006628004 synthesized 0.01008008837337752 enhanced 0.00980392156862745 experimental 0.005523336095001381 interaction 0.004418668876001105 design 0.0012427506213753107 strategy 0.0
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