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Application

Discovery Studio 0.7946040034812881 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0506454816285998 Amorphous Cell 0.2800397219463754 Blends 9.930486593843098E-4 CASTEP 0.22641509433962265 CDOCKER 0.13306852035749753 CHARMm 0.21549155908639522 COMPASS 0.3584905660377358 COMPASS III 0.12413108242303873 COSMObase 0.0029791459781529296 COSMOconf 0.012909632571996028 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 9.930486593843098E-4 COSMOtherm 0.07447864945382324 Catalyst 0.070506454816286 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08440913604766634 DFTB Plus 0.0019860973187686196 DMol3 0.1112214498510427 DPD 0.0019860973187686196 Discover 0.003972194637537239 Forcite 0.5610724925521351 GULP 0.009930486593843098 Kinetix 0.0 LUDI 9.930486593843098E-4 LibDock 0.05958291956305859 LigandFit 0.0029791459781529296 MODELER 0.19761668321747766 Mesocite 0.004965243296921549 Mesoscale 0.006951340615690168 Morphology 0.021847070506454815 ONETEP 0.0019860973187686196 Polymorph 9.930486593843098E-4 Quantum Mechanics 0.33763654419066536 Reflex 0.05759682224428997 Semi-empirical 0.0019860973187686196 Sorption 0.06554121151936444 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.5422045680238332 X-Cell 0.0 ZDOCK 0.021847070506454815

Year

2025 0.7591014717273431 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.28151027207107165 analysis 0.19156024430871738 docking 0.16435313714602998 between 0.12992781787895613 visualization 0.11826762909494726 promising 0.07828983897834536 novel 0.07551360355358135 cell 0.0694058856191005 energy 0.06662965019433648 performance 0.05830094392004442 strategy 0.04441976679622432 binding 0.038312048861743477 stability 0.034425319267073845 including 0.021654636313159357 strong 0.019988895058300944 enhanced 0.018878400888395337 synthesized 0.014991671293725709 activity 0.009439200444197668 design 0.009439200444197668 mechanism 0.00832870627429206 development 0.006662965019433648 therapeutic 0.006662965019433648 effective 0.003886729594669628 efficient 0.0
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