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Application

Discovery Studio 1.0 Materials Studio 0.8161797752808989 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0498220640569395 Amorphous Cell 0.2538552787663108 Blends 0.0011862396204033216 CASTEP 0.23902728351126928 CDOCKER 0.1915776986951364 CHARMm 0.3036773428232503 COMPASS 0.32265717674970346 COMPASS III 0.11387900355871886 COSMObase 0.002372479240806643 COSMOconf 0.00771055753262159 COSMOmic 0.0 COSMOperm 5.931198102016608E-4 COSMOplex 5.931198102016608E-4 COSMOtherm 0.05634638196915777 Catalyst 0.08600237247924081 Classical Simulations 1.0 Conformers 5.931198102016608E-4 Crystallization 0.07295373665480427 DFTB Plus 0.0017793594306049821 DMol3 0.1132858837485172 DPD 0.0017793594306049821 Discover 0.004151838671411625 Forcite 0.5041518386714117 GULP 0.008896797153024912 Kinetix 0.0 LUDI 0.0017793594306049821 LibDock 0.07829181494661921 LigandFit 0.004744958481613286 MODELER 0.265717674970344 Mesocite 0.004151838671411625 Mesoscale 0.005338078291814947 Morphology 0.01720047449584816 ONETEP 0.0011862396204033216 Polymorph 0.0017793594306049821 Quantum Mechanics 0.3505338078291815 Reflex 0.05219454329774614 Reflex Plus 0.0 Semi-empirical 0.002372479240806643 Sorption 0.05812574139976275 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7313167259786477 X-Cell 5.931198102016608E-4 ZDOCK 0.033807829181494664

Year

2025 1.0 2026 0.8672719412019023 2027 0.0

Keywords

target 1.0 potential 0.32829181494661924 docking 0.2529655990510083 analysis 0.2236061684460261 visualization 0.18001186239620404 between 0.12158956109134045 promising 0.09430604982206406 novel 0.09252669039145907 binding 0.09045077105575326 activity 0.05842230130486358 cell 0.05011862396204033 energy 0.043001186239620404 strong 0.03884934756820878 stability 0.03529062870699881 including 0.03202846975088968 therapeutic 0.029952550415183868 performance 0.022538552787663108 development 0.018683274021352312 mechanism 0.011862396204033215 strategy 0.011269276393831554 synthesized 0.010972716488730723 effective 0.00741399762752076 enhanced 0.006524317912218268 protein 0.003262158956109134 interaction 0.0
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