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Application

Discovery Studio 1.0 Materials Studio 0.9003436426116839 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05346820809248555 Amorphous Cell 0.29190751445086704 Blends 0.001445086705202312 CASTEP 0.27167630057803466 CDOCKER 0.17052023121387283 CHARMm 0.28034682080924855 COMPASS 0.3222543352601156 COMPASS III 0.1315028901734104 COSMObase 0.002890173410404624 COSMOconf 0.005780346820809248 COSMOperm 0.0 COSMOtherm 0.05635838150289017 Catalyst 0.07369942196531792 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07225433526011561 DFTB Plus 0.0 DMol3 0.1069364161849711 DPD 0.004335260115606936 Discover 0.0072254335260115606 Forcite 0.5202312138728323 GULP 0.004335260115606936 LUDI 0.0 LibDock 0.06358381502890173 LigandFit 0.0 MODELER 0.23699421965317918 Mesocite 0.005780346820809248 Mesoscale 0.008670520231213872 Morphology 0.01300578034682081 ONETEP 0.0 Polymorph 0.001445086705202312 Quantum Mechanics 0.37572254335260113 Reflex 0.05346820809248555 Reflex Plus 0.0 Semi-empirical 0.0 Sorption 0.059248554913294796 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.7572254335260116 X-Cell 0.0 ZDOCK 0.02745664739884393

Year

2025 1.0 2026 0.9550438596491229 2027 0.0

Keywords

target 1.0 potential 0.29848594087959623 docking 0.2501802451333814 analysis 0.22350396539293438 visualization 0.193943763518385 between 0.11968276856524873 promising 0.09516943042537851 binding 0.09444844989185291 novel 0.08002883922134102 activity 0.07426099495313626 cell 0.05912040374909877 energy 0.0547945205479452 strong 0.04253785147801009 stability 0.0418168709444845 performance 0.033886085075702954 including 0.03316510454217736 therapeutic 0.023071377072819033 strategy 0.017303532804614274 mechanism 0.01658255227108868 effective 0.0136986301369863 enhanced 0.011535688536409516 development 0.010814708002883922 synthesized 0.002883922134102379 interaction 0.0021629416005767843 experimental 0.0
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