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Application

Discovery Studio 0.32671394799054376 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06429840142095915 Amorphous Cell 0.29307282415630553 Blends 0.0017761989342806395 CASTEP 0.016341030195381884 CDOCKER 0.06856127886323268 CHARMm 0.2468916518650089 COMPASS 0.3428063943161634 COMPASS III 0.10230905861456484 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.0014209591474245115 Catalyst 0.0152753108348135 Classical Simulations 1.0 Conformers 7.104795737122557E-4 Crystallization 0.03872113676731794 DFTB Plus 0.0010657193605683837 DMol3 0.03268206039076377 DPD 0.0014209591474245115 Discover 0.004618117229129663 Forcite 0.544227353463588 GULP 0.013854351687388987 Kinetix 0.0 LUDI 0.0021314387211367673 LibDock 0.021314387211367674 LigandFit 0.0017761989342806395 MODELER 0.04085257548845471 Mesocite 0.0017761989342806395 Mesoscale 0.003197158081705151 Morphology 0.019182948490230906 Polymorph 0.0010657193605683837 QMERA 0.0 Quantum Mechanics 0.047246891651865006 Reflex 0.017406749555950268 Reflex Plus 0.0 Semi-empirical 0.0021314387211367673 Sorption 0.0586145648312611 Synthia 3.5523978685612787E-4 VAMP 3.5523978685612787E-4 ZDOCK 0.008170515097690942

Year

2024 0.07203907203907203 2025 0.6324786324786325 2026 1.0 2027 0.0

Keywords

target 1.0 cell 0.2651006711409396 amorphous 0.21140939597315436 between 0.1965484180249281 potential 0.1644295302013423 performance 0.15196548418024927 energy 0.1299137104506232 analysis 0.11601150527325024 enhanced 0.07142857142857142 strategy 0.06471716203259828 experimental 0.047459252157238736 mechanism 0.045062320230105465 adsorption 0.04314477468839885 novel 0.04314477468839885 stability 0.03595397890699904 promising 0.0311601150527325 design 0.029242569511025888 docking 0.023969319271332695 surface 0.023969319271332695 efficient 0.017737296260786194 effective 0.003835091083413231 temperature 0.003355704697986577 formation 9.587727708533077E-4 water 9.587727708533077E-4 interaction 0.0
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