Advanced Search

Application

Discovery Studio 1.0 Materials Studio 0.11676646706586827 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.00980392156862745 Amorphous Cell 0.032679738562091505 CASTEP 0.058823529411764705 CDOCKER 0.3562091503267974 CHARMm 0.4444444444444444 COMPASS 0.03594771241830065 COMPASS III 0.0196078431372549 COSMObase 0.0 COSMOtherm 0.0196078431372549 Catalyst 0.16013071895424835 Classical Simulations 0.5555555555555556 Crystallization 0.016339869281045753 DMol3 0.08496732026143791 Discover 0.0 Forcite 0.06209150326797386 GULP 0.0032679738562091504 LUDI 0.0 LibDock 0.12745098039215685 LigandFit 0.0032679738562091504 MODELER 0.45751633986928103 QMERA 0.0 Quantum Mechanics 0.1437908496732026 Reflex 0.016339869281045753 Semi-empirical 0.0 Visualization 1.0 ZDOCK 0.029411764705882353

Year

2024 0.08742004264392324 2025 1.0 2026 0.0

Keywords

activity 1.0 target 0.9519230769230769 docking 0.4967948717948718 potential 0.47435897435897434 analysis 0.2708333333333333 visualization 0.266025641025641 binding 0.16826923076923078 novel 0.14262820512820512 promising 0.1346153846153846 vitro 0.1266025641025641 inhibition 0.10096153846153846 silico 0.09615384615384616 compound 0.07532051282051282 synthesis 0.06891025641025642 between 0.06570512820512821 protein 0.0625 synthesized 0.052884615384615384 therapeutic 0.05128205128205128 potent 0.020833333333333332 including 0.017628205128205128 treatment 0.01282051282051282 enzyme 0.009615384615384616 development 0.00641025641025641 drug 0.0016025641025641025 effective 0.0
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