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Application

Discovery Studio 0.3419993809965955 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06297402895886003 Amorphous Cell 0.28361296253734775 Blends 0.002068490002298322 CASTEP 0.018156745575729716 CDOCKER 0.07262698230291886 CHARMm 0.2555734313950816 COMPASS 0.3468168237186854 COMPASS III 0.09767869455297633 COSMObase 0.0 COSMOplex 0.0 COSMOquick 2.2983222247759135E-4 COSMOtherm 0.001378993334865548 Catalyst 0.01356010112617789 Classical Simulations 1.0 Conformers 2.2983222247759135E-4 Crystallization 0.03631349115145943 DFTB Plus 0.0016088255573431394 DMol3 0.031257182256952426 DPD 0.0011491611123879567 Discover 0.004366812227074236 Forcite 0.5325212594805792 GULP 0.019305906688117675 LUDI 0.002068490002298322 LibDock 0.01999540335555045 LigandFit 0.0022983222247759134 MODELER 0.0425189611583544 MesoDyn 0.0 Mesocite 0.001378993334865548 Mesoscale 0.002757986669731096 Modules 0.0 Morphology 0.01677775224086417 Polymorph 0.002068490002298322 QMERA 2.2983222247759135E-4 Quantum Mechanics 0.047805102275339004 Reflex 0.01700758446334176 Reflex Plus 0.0 Semi-empirical 0.002757986669731096 Sorption 0.05607906228453229 Synthia 4.596644449551827E-4 VAMP 4.596644449551827E-4 ZDOCK 0.008044127786715698

Year

2024 0.15672676837725383 2025 0.8441978733240869 2026 1.0 2027 0.0

Keywords

target 1.0 cell 0.25626145387904703 between 0.20769700671960903 amorphous 0.19853390348197922 potential 0.1740989615149664 performance 0.14935858277336592 energy 0.14569334147831398 analysis 0.11026267562614539 enhanced 0.058338423946243126 experimental 0.05375687232742822 novel 0.05222968845448992 strategy 0.047037263286499695 adsorption 0.04245571166768479 mechanism 0.040012217470983505 stability 0.03756872327428222 promising 0.032376298106292 docking 0.028711056811240074 surface 0.028711056811240074 design 0.022602321319486866 interaction 0.018937080024434942 effective 0.010384850335980453 efficient 0.010079413561392792 development 0.003359804520464264 water 0.0015271838729383018 temperature 0.0
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