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Application

Discovery Studio 0.9300822561692127 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06200997861724875 Amorphous Cell 0.28296507483962935 Blends 0.0021382751247327157 CASTEP 0.3171774768353528 CDOCKER 0.15609408410548825 CHARMm 0.25160370634354956 COMPASS 0.3421240199572345 COMPASS III 0.11689237348538846 COSMObase 0.003563791874554526 COSMOconf 0.005702066999287242 COSMOmic 0.0 COSMOperm 7.127583749109052E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.06628652886671418 Catalyst 0.0691375623663578 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07697790449037777 DFTB Plus 0.0014255167498218105 DMol3 0.1382751247327156 DPD 0.0021382751247327157 Discover 0.0021382751247327157 Forcite 0.5345687811831789 GULP 0.012116892373485389 LUDI 0.002851033499643621 LibDock 0.06200997861724875 LigandFit 0.0021382751247327157 MODELER 0.22808267997148968 Mesocite 0.0042765502494654314 Mesoscale 0.007127583749109052 Morphology 0.01781895937277263 ONETEP 7.127583749109052E-4 Polymorph 0.0 QMERA 0.0 Quantum Mechanics 0.451176051318603 Reflex 0.05702066999287242 Reflex Plus 0.0 Semi-empirical 0.003563791874554526 Sorption 0.05274411974340699 Synthia 7.127583749109052E-4 TURBOMOLE 0.0 VAMP 7.127583749109052E-4 Visualization 0.66928011404134 X-Cell 0.0 ZDOCK 0.022808267997148968

Year

2024 0.04090909090909091 2025 0.9886363636363636 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.32195676905574516 analysis 0.22753128555176336 docking 0.21843003412969283 visualization 0.17102768297307547 between 0.14372392870686387 promising 0.09783845278725825 novel 0.08835798255593477 binding 0.07356844899507016 energy 0.07129313613955252 cell 0.07091391733029959 stability 0.05802047781569966 performance 0.05081532043989382 activity 0.04929844520288206 strong 0.030716723549488054 including 0.026924535456958665 enhanced 0.02427000379218809 effective 0.019719378081152827 development 0.01820250284414107 strategy 0.017444065225635193 mechanism 0.015547971179370497 synthesized 0.01441031475161168 design 0.011755783086841108 interaction 0.0034129692832764505 experimental 0.0
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