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Application

Discovery Studio 0.44200626959247646 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05123751628310899 Amorphous Cell 0.2596613113330439 Blends 0.0013026487190620929 CASTEP 0.013026487190620929 CDOCKER 0.08597481545809814 CHARMm 0.3065566652192792 COMPASS 0.32305688232739904 COMPASS III 0.09986973512809379 COSMOplex 0.0 COSMOtherm 4.342162396873643E-4 Catalyst 0.014763352149370386 Classical Simulations 1.0 Conformers 4.342162396873643E-4 Crystallization 0.03430308293530178 DFTB Plus 8.684324793747286E-4 DMol3 0.02518454190186713 DPD 0.0 Discover 0.0034737299174989146 Forcite 0.4945722970039079 GULP 0.011723838471558836 LUDI 0.0013026487190620929 LibDock 0.0243161094224924 LigandFit 0.0021710811984368217 MODELER 0.05254016500217108 Mesocite 0.0013026487190620929 Mesoscale 0.0013026487190620929 Morphology 0.016500217108119844 Polymorph 0.0017368649587494573 QMERA 0.0 Quantum Mechanics 0.03690838037342597 Reflex 0.015197568389057751 Semi-empirical 0.0021710811984368217 Sorption 0.05644811115935736 Synthia 4.342162396873643E-4 VAMP 4.342162396873643E-4 ZDOCK 0.010421189752496743

Year

2024 0.02082018927444795 2025 0.4176656151419558 2026 1.0 2027 0.0

Keywords

target 1.0 cell 0.2360774818401937 potential 0.20702179176755447 between 0.1761501210653753 amorphous 0.1694915254237288 analysis 0.1368038740920097 performance 0.13559322033898305 energy 0.12772397094430993 strategy 0.07808716707021791 docking 0.06900726392251816 enhanced 0.05447941888619855 novel 0.053268765133171914 promising 0.044794188861985475 stability 0.04055690072639225 mechanism 0.038135593220338986 design 0.03571428571428571 experimental 0.03208232445520581 adsorption 0.030871670702179176 efficient 0.016343825665859565 effective 0.010290556900726392 strong 0.010290556900726392 binding 0.009079903147699757 development 0.007869249394673124 interaction 0.00423728813559322 surface 0.0
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