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Application

Discovery Studio 1.0 Materials Studio 0.4191679831490258 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04161979752530934 Amorphous Cell 0.1732283464566929 Blends 0.0 CASTEP 0.23959505061867267 CDOCKER 0.40719910011248595 CHARMm 0.47581552305961755 COMPASS 0.2823397075365579 COMPASS III 0.06299212598425197 COSMObase 0.0 COSMOperm 0.0 COSMOquick 0.0022497187851518562 COSMOtherm 0.04049493813273341 Catalyst 0.25984251968503935 Classical Simulations 1.0 Crystallization 0.052868391451068614 DMol3 0.12373453318335208 DPD 0.0011248593925759281 Discover 0.0011248593925759281 Forcite 0.3734533183352081 GULP 0.0044994375703037125 LUDI 0.008998875140607425 LibDock 0.13948256467941508 LigandFit 0.010123734533183352 MODELER 0.43194600674915634 Mesoscale 0.0011248593925759281 Morphology 0.01124859392575928 ONETEP 0.0 Polymorph 0.0044994375703037125 Quantum Mechanics 0.35995500562429694 Reflex 0.0359955005624297 Reflex Plus 0.0 Sorption 0.02249718785151856 Visualization 0.9797525309336333 ZDOCK 0.03487064116985377

Year

2023 0.0916030534351145 2024 0.5218598195697433 2025 1.0 2026 0.3337959750173491 2027 0.0

Keywords

novel 1.0 target 0.935803532959931 potential 0.3864713485566566 docking 0.3455407152089617 analysis 0.1874192158552348 visualization 0.16803102111158982 promising 0.14562688496337786 synthesized 0.13700990952175787 activity 0.11331322705730289 binding 0.1055579491598449 development 0.0947867298578199 synthesis 0.09004739336492891 compound 0.06850495476087894 between 0.05644118914261095 therapeutic 0.04093063334769496 vitro 0.024127531236535976 protein 0.01938819474364498 drug 0.01809564842740198 inhibition 0.01809564842740198 potent 0.017664799655320983 effective 0.016372253339077984 stability 0.014218009478672985 design 0.006893580353295993 including 0.003015941404566997 cell 0.0
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