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Application

Discovery Studio 1.0 Materials Studio 0.7528925619834711 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04759141033081834 Amorphous Cell 0.2576900754497969 Blends 0.0011607661056297156 CASTEP 0.24724318049912944 CDOCKER 0.1950087057457922 CHARMm 0.3128264654672084 COMPASS 0.3186302959953569 COMPASS III 0.10969239698200813 COSMObase 0.0046430644225188625 COSMOconf 0.008705745792222866 COSMOmic 0.0 COSMOperm 5.803830528148578E-4 COSMOplex 5.803830528148578E-4 COSMOtherm 0.0661636680208938 Catalyst 0.08647707486941382 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07312826465467208 DFTB Plus 0.004062681369704005 DMol3 0.11375507835171213 DPD 0.0011607661056297156 Discover 0.0023215322112594312 Forcite 0.4863609982588508 GULP 0.011607661056297156 Kinetix 0.0 LUDI 0.002901915264074289 LibDock 0.08009286128845038 LigandFit 0.0023215322112594312 MODELER 0.293673824724318 Mesocite 0.004062681369704005 Mesoscale 0.00522344747533372 Morphology 0.016831108531630876 ONETEP 0.0011607661056297156 Polymorph 0.0017411491584445734 Quantum Mechanics 0.3575159605339524 Reflex 0.0522344747533372 Reflex Plus 0.0 Semi-empirical 0.0046430644225188625 Sorption 0.05977945443993035 Synthia 0.0011607661056297156 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7887405687753918 X-Cell 5.803830528148578E-4 ZDOCK 0.03192106790481718

Year

2024 0.012067578439259855 2025 1.0 2026 0.8238133547868061 2027 0.0

Keywords

target 1.0 potential 0.34634007405297634 docking 0.2751352890914269 analysis 0.2409569923098832 visualization 0.19851894047279978 between 0.11649102819709485 binding 0.10424380518370835 promising 0.10395898604386215 novel 0.09968669894616919 activity 0.06835659356308744 cell 0.0484192537738536 stability 0.043577328396468246 energy 0.04101395613785246 including 0.035887211620620904 therapeutic 0.031330105383081744 strong 0.02962119054400456 effective 0.017943605810310452 development 0.016804329250925662 performance 0.011677584733694105 protein 0.01082312731415551 synthesized 0.009968669894616918 mechanism 0.00968385075477072 strategy 0.008259755055539733 interaction 8.54457419538593E-4 enhanced 0.0
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