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Application

Discovery Studio 1.0 Materials Studio 0.6400182731841023 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05969049373618276 Amorphous Cell 0.24244657332350775 Blends 0.0029476787030213707 CASTEP 0.27339719970523213 CDOCKER 0.22328666175386883 CHARMm 0.3728813559322034 COMPASS 0.29255711127487105 COMPASS III 0.09801031687546058 COSMObase 0.004421518054532056 COSMOconf 0.004421518054532056 COSMOperm 7.369196757553427E-4 COSMOquick 0.0 COSMOtherm 0.0552689756816507 Catalyst 0.09874723655121592 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06705969049373618 DFTB Plus 0.0 DMol3 0.11938098747236552 DPD 0.0029476787030213707 Discover 0.0058953574060427415 Forcite 0.4509948415622697 GULP 0.008106116433308769 LUDI 0.0058953574060427415 LibDock 0.09137803979366249 LigandFit 0.0036845983787767134 MODELER 0.32792925571112747 MesoDyn 0.0 Mesocite 0.0029476787030213707 Mesoscale 0.0058953574060427415 Morphology 0.01400147383935151 ONETEP 0.0 Polymorph 0.002210759027266028 QSAR 7.369196757553427E-4 Quantum Mechanics 0.3868828297715549 Reflex 0.04863669859985262 Reflex Plus 0.0 Semi-empirical 7.369196757553427E-4 Sorption 0.04642593957258659 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.8614591009579956 X-Cell 7.369196757553427E-4 ZDOCK 0.04126750184229919

Year

2024 0.3038251366120219 2025 1.0 2026 0.7879781420765027 2027 0.0

Keywords

target 1.0 potential 0.31553249923710713 docking 0.2813548977723528 analysis 0.2187976808056149 visualization 0.18950259383582546 binding 0.11840097650289899 between 0.1095514189807751 novel 0.09826060421116875 promising 0.09246261824839792 activity 0.07567897467195606 cell 0.04211168751907232 stability 0.0320415013732072 strong 0.028989929813854134 protein 0.027158986878242294 including 0.025938358254501068 therapeutic 0.025938358254501068 effective 0.02563320109856576 energy 0.022886786695148 development 0.01922490082392432 synthesized 0.01647848642050656 interaction 0.009459871833994507 mechanism 0.00640830027464144 synthesis 0.003967043027158987 enhanced 0.0 silico 0.0
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