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Application

Discovery Studio 1.0 Materials Studio 0.61437535653166 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.046168051708217916 Amorphous Cell 0.23084025854108955 Blends 0.0 CASTEP 0.2502308402585411 CDOCKER 0.23268698060941828 CHARMm 0.3656509695290859 COMPASS 0.283471837488458 COMPASS III 0.10249307479224377 COSMObase 0.002770083102493075 COSMOconf 0.009233610341643583 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 9.233610341643582E-4 COSMOquick 0.0 COSMOtherm 0.07017543859649122 Catalyst 0.09879963065558633 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06463527239150507 DFTB Plus 0.00554016620498615 DMol3 0.12003693444136658 Forcite 0.44321329639889195 GULP 0.01662049861495845 Kinetix 0.0 LUDI 0.0046168051708217915 LibDock 0.0951061865189289 LigandFit 0.003693444136657433 MODELER 0.3545706371191136 Mesocite 9.233610341643582E-4 Mesoscale 9.233610341643582E-4 Morphology 0.017543859649122806 ONETEP 9.233610341643582E-4 Polymorph 9.233610341643582E-4 Quantum Mechanics 0.3656509695290859 Reflex 0.04339796860572484 Semi-empirical 0.006463527239150508 Sorption 0.055401662049861494 Synthia 9.233610341643582E-4 VAMP 0.0 Visualization 0.863342566943675 X-Cell 0.0 ZDOCK 0.03693444136657433

Year

2024 0.11199510403916768 2025 1.0 2026 0.7509179926560587 2027 0.0

Keywords

target 1.0 potential 0.32858791843016544 docking 0.2670257791458253 analysis 0.21085032704886494 visualization 0.1819930742593305 binding 0.10311658330126972 between 0.10042323970757984 novel 0.09311273566756445 promising 0.08272412466333205 activity 0.05925355906117737 cell 0.029626779530588686 including 0.029242016160061564 stability 0.025394382454790303 energy 0.02308580223162755 protein 0.02193151212004617 therapeutic 0.020777222008464793 development 0.01654482493266641 strong 0.011158137745286649 silico 0.008080030781069641 synthesis 0.006540977298961139 synthesized 0.006540977298961139 vitro 0.005771450557906887 effective 0.005001923816852636 mechanism 0.0026933435936898806 interaction 0.0
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