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Application

Discovery Studio 0.8422567645365573 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06341933928140825 Amorphous Cell 0.29225946467325775 Blends 0.0024113817217265494 CASTEP 0.3359054738365083 CDOCKER 0.15071135760790932 CHARMm 0.2445141065830721 COMPASS 0.34892693513383166 COMPASS III 0.11044128285507596 COSMObase 0.005546177959971064 COSMOconf 0.006028454304316373 COSMOmic 0.0 COSMOperm 4.822763443453099E-4 COSMOplex 2.4113817217265494E-4 COSMOquick 0.0012056908608632747 COSMOtherm 0.0680009645526887 Catalyst 0.06824210272486135 Classical Simulations 1.0 Conformers 4.822763443453099E-4 Crystallization 0.07523510971786834 DFTB Plus 0.003134796238244514 DMol3 0.15746322642874366 DPD 0.002652519893899204 Discover 0.004822763443453099 Forcite 0.5444899927658549 GULP 0.017844224740776463 Kinetix 2.4113817217265494E-4 LUDI 0.003617072582589824 LibDock 0.061490233904027004 LigandFit 0.0028936580660718593 MODELER 0.2290812635640222 MesoDyn 7.234145165179648E-4 Mesocite 0.003375934410417169 Mesoscale 0.0065107306486616836 Morphology 0.0171208102242585 ONETEP 9.645526886906198E-4 Polymorph 0.0021702435495538942 QMERA 2.4113817217265494E-4 QSAR 7.234145165179648E-4 Quantum Mechanics 0.4837231733783458 Reflex 0.05449722691102001 Reflex Plus 7.234145165179648E-4 Semi-empirical 0.004581625271280444 Sorption 0.0588377140101278 Synthia 0.0012056908608632747 TURBOMOLE 0.0 VAMP 7.234145165179648E-4 Visualization 0.6231010368941403 X-Cell 0.0014468290330359296 ZDOCK 0.025078369905956112

Year

2024 0.21395617070357556 2025 1.0 2026 0.7952710495963091 2027 0.0

Keywords

target 1.0 potential 0.294030035993546 analysis 0.2108725332009433 docking 0.19225518182946505 between 0.14782176988953705 visualization 0.13900955690703737 energy 0.08638451036365893 promising 0.08390219684746184 novel 0.08241280873774358 cell 0.06826362169542013 binding 0.05994787141615986 performance 0.05361797194985727 stability 0.04356460220925903 activity 0.03028422489760457 including 0.019362045426337345 enhanced 0.019113814074717638 strong 0.017003847585950107 experimental 0.01452153406975301 effective 0.014149187042323446 development 0.00856398163087998 mechanism 0.008439865955070125 synthesized 0.008315750279260271 strategy 0.004964627032394192 design 9.929254064788382E-4 interaction 0.0
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