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Application

Discovery Studio 0.7416879795396419 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.019553072625698324 Amorphous Cell 0.3575418994413408 CASTEP 0.21508379888268156 CDOCKER 0.1340782122905028 CHARMm 0.2430167597765363 COMPASS 0.3240223463687151 COMPASS III 0.13687150837988826 COSMObase 0.00558659217877095 COSMOconf 0.0 COSMOplex 0.0 COSMOtherm 0.0782122905027933 Catalyst 0.16201117318435754 Classical Simulations 1.0 Crystallization 0.07262569832402235 DFTB Plus 0.00558659217877095 DMol3 0.1340782122905028 Discover 0.002793296089385475 Forcite 0.5279329608938548 GULP 0.013966480446927373 Kinetix 0.0 LUDI 0.00558659217877095 LibDock 0.05865921787709497 MODELER 0.13128491620111732 Mesocite 0.002793296089385475 Mesoscale 0.002793296089385475 Morphology 0.013966480446927373 ONETEP 0.0 Polymorph 0.0 QMERA 0.0 Quantum Mechanics 0.3463687150837989 Reflex 0.05307262569832402 Semi-empirical 0.008379888268156424 Sorption 0.061452513966480445 Visualization 0.4106145251396648 ZDOCK 0.027932960893854747

Year

2024 0.04100227790432802 2025 0.6902050113895216 2026 1.0 2027 0.0

Keywords

design 1.0 target 0.8738170347003155 potential 0.21766561514195584 synthesis 0.14037854889589904 promising 0.12460567823343849 analysis 0.12145110410094637 docking 0.11987381703470032 novel 0.11514195583596215 performance 0.09936908517350158 cell 0.09305993690851735 between 0.0914826498422713 synthesized 0.07728706624605679 energy 0.07097791798107256 development 0.06466876971608833 strategy 0.056782334384858045 stability 0.04889589905362776 visualization 0.025236593059936908 effective 0.012618296529968454 strong 0.012618296529968454 binding 0.011041009463722398 compound 0.011041009463722398 efficient 0.006309148264984227 activity 0.00473186119873817 enhanced 0.0015772870662460567 including 0.0
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