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Application

Discovery Studio 0.12613430127041741 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.14965034965034965 Amorphous Cell 0.3384615384615385 CASTEP 0.35804195804195804 CDOCKER 0.016783216783216783 CHARMm 0.044755244755244755 COMPASS 0.48951048951048953 COMPASS III 0.0965034965034965 COSMOtherm 0.013986013986013986 Catalyst 0.008391608391608392 Classical Simulations 1.0 Crystallization 0.05454545454545454 DFTB Plus 0.008391608391608392 DMol3 0.23076923076923078 Discover 0.006993006993006993 Forcite 0.6895104895104895 GULP 0.005594405594405594 Kinetix 0.0 LibDock 0.004195804195804196 MODELER 0.039160839160839164 MesoDyn 0.0 Mesocite 0.0 Mesoscale 0.0013986013986013986 Morphology 0.019580419580419582 Quantum Mechanics 0.5734265734265734 Reflex 0.032167832167832165 Reflex Plus 0.0 Semi-empirical 0.008391608391608392 Sorption 0.04055944055944056 TURBOMOLE 0.0 Visualization 0.1958041958041958 ZDOCK 0.008391608391608392

Year

2023 0.04277286135693215 2024 0.25073746312684364 2025 1.0 2026 0.5796460176991151 2027 0.0

Keywords

surface 1.0 target 0.8930875576036866 between 0.25069124423963135 adsorption 0.22304147465437787 energy 0.1695852534562212 performance 0.14746543778801843 analysis 0.10783410138248847 cell 0.08940092165898618 experimental 0.08663594470046083 enhanced 0.08571428571428572 potential 0.07373271889400922 amorphous 0.05714285714285714 mechanism 0.04055299539170507 interaction 0.035944700460829496 stability 0.03133640552995392 formation 0.027649769585253458 water 0.026728110599078342 higher 0.020276497695852536 effective 0.012903225806451613 efficient 0.011981566820276499 novel 0.009216589861751152 applied 0.008294930875576038 stable 0.0064516129032258064 chemical 0.005529953917050691 concentration 0.0
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