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Application

Discovery Studio 1.0 Materials Studio 0.7695360952617216 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05391120507399577 Amorphous Cell 0.255461592670895 Blends 0.0021141649048625794 CASTEP 0.28012684989429176 CDOCKER 0.19661733615221988 CHARMm 0.32064834390415786 COMPASS 0.3171247357293869 COMPASS III 0.10042283298097252 COSMObase 0.004228329809725159 COSMOconf 0.006342494714587738 COSMOmic 0.0 COSMOperm 7.047216349541931E-4 COSMOplex 3.5236081747709656E-4 COSMOquick 0.0 COSMOtherm 0.059901338971106416 Catalyst 0.08527131782945736 Classical Simulations 1.0 Conformers 3.5236081747709656E-4 Crystallization 0.06800563777307964 DFTB Plus 0.0024665257223396757 DMol3 0.12931642001409444 DPD 0.0014094432699083862 Discover 0.003875968992248062 Forcite 0.48590556730091616 GULP 0.013037350246652573 Kinetix 0.0 LUDI 0.004933051444679351 LibDock 0.0817477096546864 LigandFit 0.0035236081747709656 MODELER 0.3037350246652572 MesoDyn 0.0 Mesocite 0.0035236081747709656 Mesoscale 0.004933051444679351 Morphology 0.015503875968992248 ONETEP 7.047216349541931E-4 Polymorph 0.0021141649048625794 QMERA 0.0 QSAR 3.5236081747709656E-4 Quantum Mechanics 0.40274841437632136 Reflex 0.04933051444679352 Reflex Plus 0.0 Semi-empirical 0.0035236081747709656 Sorption 0.052854122621564484 Synthia 7.047216349541931E-4 TURBOMOLE 0.0 VAMP 3.5236081747709656E-4 Visualization 0.7780126849894292 X-Cell 0.0014094432699083862 ZDOCK 0.034178999295278366

Year

2024 0.20242024202420242 2025 1.0 2026 0.8976897689768977 2027 0.0

Keywords

target 1.0 potential 0.3499050578284136 docking 0.28102882789573624 analysis 0.2428793371310202 visualization 0.1954082513378215 between 0.1318833074400138 binding 0.11030554117037804 novel 0.1046090108751942 promising 0.10150181253236665 activity 0.0685309856723632 cell 0.05454859312963922 energy 0.04816157431382703 stability 0.044018643190056966 including 0.03124460555843259 strong 0.031071983428275506 effective 0.0236492318315208 development 0.02054203348869325 therapeutic 0.01967892283790782 protein 0.018815812187122388 performance 0.017262213015708613 synthesized 0.013809770412566891 mechanism 0.011393060590367685 interaction 0.00983946141895391 enhanced 0.007077507336440532 synthesis 0.0
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