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Application

Discovery Studio 1.0 Materials Studio 0.6775956284153005 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04984423676012461 Amorphous Cell 0.22118380062305296 CASTEP 0.3987538940809969 CDOCKER 0.21495327102803738 CHARMm 0.3146417445482866 COMPASS 0.2834890965732087 COMPASS III 0.09657320872274143 COSMObase 0.0 COSMOconf 0.003115264797507788 COSMOtherm 0.102803738317757 Catalyst 0.12149532710280374 Classical Simulations 0.9626168224299065 Crystallization 0.08099688473520249 DFTB Plus 0.003115264797507788 DMol3 0.1557632398753894 DPD 0.0 Forcite 0.45794392523364486 GULP 0.03115264797507788 Kinetix 0.0 LUDI 0.003115264797507788 LibDock 0.09345794392523364 LigandFit 0.003115264797507788 MODELER 0.3644859813084112 MesoDyn 0.0 Mesoscale 0.003115264797507788 Morphology 0.009345794392523364 Polymorph 0.003115264797507788 Quantum Mechanics 0.5482866043613707 Reflex 0.06542056074766354 Semi-empirical 0.006230529595015576 Sorption 0.040498442367601244 Synthia 0.0 VAMP 0.0 Visualization 1.0 ZDOCK 0.028037383177570093

Year

2023 0.0 2024 0.7152317880794702 2025 1.0 2026 0.37748344370860926

Keywords

well 1.0 target 0.9280742459396751 potential 0.3468677494199536 docking 0.2865429234338747 analysis 0.19953596287703015 visualization 0.1902552204176334 between 0.1334106728538283 binding 0.10556844547563805 novel 0.08932714617169374 activity 0.08816705336426914 promising 0.07192575406032482 including 0.04756380510440835 cell 0.03944315545243619 energy 0.03944315545243619 vitro 0.030162412993039442 mechanism 0.025522041763341066 synthesized 0.025522041763341066 stability 0.02320185614849188 silico 0.022041763341067284 experimental 0.018561484918793503 synthesis 0.015081206496519721 development 0.010440835266821345 protein 0.004640371229698376 effective 0.002320185614849188 compound 0.0
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