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Application

Discovery Studio 0.9997416688194265 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06198473282442748 Amorphous Cell 0.2766412213740458 Blends 0.0024427480916030535 CASTEP 0.3114503816793893 CDOCKER 0.17068702290076335 CHARMm 0.2784732824427481 COMPASS 0.3316030534351145 COMPASS III 0.10931297709923664 COSMObase 0.004580152671755725 COSMOconf 0.006717557251908397 COSMOmic 0.0 COSMOperm 6.106870229007634E-4 COSMOplex 3.053435114503817E-4 COSMOquick 0.0012213740458015267 COSMOtherm 0.06748091603053435 Catalyst 0.07267175572519084 Classical Simulations 1.0 Conformers 3.053435114503817E-4 Crystallization 0.07145038167938932 DFTB Plus 0.003969465648854962 DMol3 0.1483969465648855 DPD 0.002748091603053435 Discover 0.004580152671755725 Forcite 0.5166412213740458 GULP 0.01648854961832061 Kinetix 0.0 LUDI 0.00366412213740458 LibDock 0.07022900763358779 LigandFit 0.0033587786259541984 MODELER 0.25099236641221373 MesoDyn 6.106870229007634E-4 Mesocite 0.0024427480916030535 Mesoscale 0.00549618320610687 Modules 0.0 Morphology 0.01618320610687023 ONETEP 9.16030534351145E-4 Polymorph 0.002137404580152672 QMERA 0.0 QSAR 6.106870229007634E-4 Quantum Mechanics 0.45221374045801527 Reflex 0.0516030534351145 Reflex Plus 6.106870229007634E-4 Semi-empirical 0.004885496183206107 Sorption 0.055877862595419846 Synthia 9.16030534351145E-4 TURBOMOLE 0.0 VAMP 3.053435114503817E-4 Visualization 0.6705343511450381 X-Cell 0.0012213740458015267 ZDOCK 0.02931297709923664

Year

2024 0.16311420237828136 2025 1.0 2026 0.7233565178371102 2027 0.0

Keywords

target 1.0 potential 0.2830684174153421 docking 0.19930891499654457 analysis 0.19336558396682793 visualization 0.13959917069799585 between 0.1271596406357982 novel 0.08334485141672426 promising 0.08085694540428473 binding 0.07201105736005528 energy 0.0653766413268832 cell 0.05722183828610919 activity 0.040359364201796824 stability 0.034139599170698 performance 0.03275742916378715 including 0.024464409122322044 strong 0.020317899101589494 effective 0.016447823082239115 development 0.01437456807187284 synthesized 0.011333794056668971 enhanced 0.00939875604699378 mechanism 0.00663441603317208 interaction 0.0030407740152038703 design 0.0019350380096751902 strategy 0.0011057360055286801 experimental 0.0
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