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Application

Discovery Studio 1.0 Materials Studio 0.012219787628518455 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.003184252424374005 Amorphous Cell 0.001881603705311912 Blends 0.0 CASTEP 0.0014473874656245477 CDOCKER 0.1974236503111883 CHARMm 0.30105659284990594 COMPASS 0.004921117383123462 COMPASS III 0.001157909972499638 COSMOperm 0.0 COSMOtherm 8.684324793747286E-4 Catalyst 0.15863366623245043 Classical Simulations 0.3136488638008395 Crystallization 0.001157909972499638 DMol3 0.006513243595310464 Forcite 0.007526414821247648 GULP 1.4473874656245476E-4 LUDI 0.006802721088435374 LibDock 0.08177739180778694 LigandFit 0.0066579823418729195 MCSS 8.684324793747286E-4 MODELER 0.2108843537414966 Polymorph 0.0 QSAR 5.78954986249819E-4 Quantum Mechanics 0.007960631060935012 Reflex 0.0010131712259371835 Sorption 4.342162396873643E-4 Visualization 1.0 X-Cell 2.894774931249095E-4 ZDOCK 0.025329280648429583

Year

2020 0.0031397174254317113 2021 0.4546310832025118 2022 0.6270015698587127 2023 0.8562009419152277 2024 1.0 2025 0.7400313971742544 2026 0.0

Keywords

docking 1.0 target 0.9699346405228758 visualization 0.4875816993464052 potential 0.44766214177978886 analysis 0.3246857717445953 binding 0.29421820010055305 activity 0.17647058823529413 protein 0.16701860231271995 novel 0.15475113122171946 silico 0.13403720462543992 vitro 0.11452991452991453 drug 0.11040723981900452 compound 0.106184012066365 interaction 0.08707893413775766 between 0.08577174459527401 synthesis 0.08265460030165912 inhibition 0.08064353946706888 synthesized 0.07280040221216692 promising 0.046153846153846156 treatment 0.043137254901960784 therapeutic 0.03459024635495224 potent 0.02091503267973856 active 0.009653092006033183 including 0.004725992961287079 development 0.0
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