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Application

Discovery Studio 1.0 Materials Studio 0.4214162348877375 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06802030456852792 Amorphous Cell 0.09137055837563451 Blends 0.0010152284263959391 CASTEP 0.1949238578680203 CDOCKER 0.1918781725888325 CHARMm 0.30761421319796955 COMPASS 0.15736040609137056 COMPASS III 0.04365482233502538 COSMObase 0.0 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.027411167512690356 Catalyst 0.2923857868020305 Classical Simulations 0.7045685279187818 Crystallization 0.07106598984771574 DFTB Plus 0.0020304568527918783 DMol3 0.12284263959390863 Discover 0.0010152284263959391 Forcite 0.2700507614213198 GULP 0.01116751269035533 LUDI 0.003045685279187817 LibDock 0.07208121827411168 LigandFit 0.0 MCSS 0.0 MODELER 0.21725888324873097 Mesocite 0.0 Mesoscale 0.0 Morphology 0.012182741116751269 QSAR 0.0 Quantum Mechanics 0.31269035532994927 Reflex 0.05786802030456853 Reflex Plus 0.0 Semi-empirical 0.0020304568527918783 Sorption 0.027411167512690356 Visualization 1.0 ZDOCK 0.01015228426395939

Year

2023 0.04365079365079365 2024 0.7579365079365079 2025 1.0 2026 0.2261904761904762 2027 0.0

Keywords

synthesis 1.0 target 0.9651324965132496 docking 0.4063226406322641 synthesized 0.3947001394700139 potential 0.33147373314737333 visualization 0.2687122268712227 novel 0.2570897257089726 analysis 0.17201301720130172 compound 0.1678289167828917 activity 0.15434681543468154 design 0.14458391445839144 promising 0.14411901441190145 binding 0.10367271036727103 vitro 0.07252440725244072 potent 0.06601580660158066 inhibition 0.06322640632264064 between 0.05299860529986053 silico 0.038586703858670385 development 0.008833100883310088 strong 0.00604370060437006 evaluation 0.003719200371920037 including 0.0032543003254300326 effective 0.0018596001859600185 drug 4.6490004649000463E-4 active 0.0
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