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Application

Discovery Studio 0.7796709753231492 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.053609721229449604 Amorphous Cell 0.29949964260185846 Blends 0.0014295925661186562 CASTEP 0.27662616154395997 CDOCKER 0.135096497498213 CHARMm 0.21801286633309508 COMPASS 0.35525375268048603 COMPASS III 0.1322373123659757 COSMObase 0.0028591851322373124 COSMOconf 0.009292351679771264 COSMOmic 0.0 COSMOperm 7.147962830593281E-4 COSMOplex 7.147962830593281E-4 COSMOtherm 0.06576125804145819 Catalyst 0.07005003573981415 Classical Simulations 1.0 Conformers 7.147962830593281E-4 Crystallization 0.08577555396711938 DFTB Plus 0.0028591851322373124 DMol3 0.12508934953538242 DPD 0.002144388849177984 Discover 0.005003573981415297 Forcite 0.5682630450321658 GULP 0.009292351679771264 Kinetix 0.0 LUDI 0.0014295925661186562 LibDock 0.057898498927805575 LigandFit 7.147962830593281E-4 MODELER 0.18942101501072195 Mesocite 0.005003573981415297 Mesoscale 0.006433166547533953 Morphology 0.020014295925661188 ONETEP 0.0014295925661186562 Polymorph 0.002144388849177984 Quantum Mechanics 0.3995711222301644 Reflex 0.061472480343102216 Reflex Plus 0.0 Semi-empirical 0.0028591851322373124 Sorption 0.06719085060757685 Synthia 0.0014295925661186562 TURBOMOLE 0.0 Visualization 0.5868477483917084 X-Cell 7.147962830593281E-4 ZDOCK 0.02215868477483917

Year

2025 0.7498672331386086 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.28391167192429023 analysis 0.19873817034700317 docking 0.18138801261829654 visualization 0.13485804416403785 between 0.12302839116719243 promising 0.08123028391167192 energy 0.07610410094637224 cell 0.06979495268138801 novel 0.06703470031545741 performance 0.06427444794952682 binding 0.050078864353312304 strategy 0.03746056782334385 stability 0.03588328075709779 activity 0.033517350157728706 strong 0.03194006309148265 including 0.022870662460567823 mechanism 0.016561514195583597 enhanced 0.015378548895899053 effective 0.011041009463722398 design 0.008675078864353312 synthesized 0.007097791798107256 experimental 0.004337539432176656 therapeutic 0.001971608832807571 development 0.0
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