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Application

Discovery Studio 1.0 Materials Studio 0.07225229465756648 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.010516689529035207 Amorphous Cell 0.02880658436213992 Blends 4.572473708276177E-4 CASTEP 0.03566529492455418 CDOCKER 0.23868312757201646 CHARMm 0.3836305441243713 COMPASS 0.04572473708276177 COMPASS III 0.0054869684499314125 COSMOperm 4.572473708276177E-4 COSMOtherm 0.007773205304069501 Catalyst 0.149519890260631 Classical Simulations 0.47005029721079106 Crystallization 0.00823045267489712 DFTB Plus 9.144947416552355E-4 DMol3 0.01646090534979424 DPD 9.144947416552355E-4 Forcite 0.058070416095107456 GULP 0.003657978966620942 LUDI 0.00411522633744856 LibDock 0.10242341106538637 LigandFit 0.006858710562414266 MCSS 0.0013717421124828531 MODELER 0.3534522176497485 MesoDyn 4.572473708276177E-4 Mesocite 0.0 Mesoscale 0.001828989483310471 Morphology 0.001828989483310471 ONETEP 0.0 Quantum Mechanics 0.05212620027434842 Reflex 0.00594421582075903 Semi-empirical 0.0013717421124828531 Sorption 0.004572473708276178 TURBOMOLE 0.0 VAMP 0.0 Visualization 1.0 ZDOCK 0.04069501600365798

Year

2024 0.0

Keywords

target 1.0 docking 0.5170195658000536 potential 0.41222192441704636 visualization 0.3808630393996248 analysis 0.26775663361029217 binding 0.19967837041007772 activity 0.1487536853390512 novel 0.14098097024926293 protein 0.13803269900830875 between 0.08040739748056822 vitro 0.07799517555615117 silico 0.06861431251675154 promising 0.05414098097024926 drug 0.04931653712141517 compound 0.04824443848834093 therapeutic 0.04395604395604396 synthesis 0.04261592066470115 treatment 0.04127579737335835 interaction 0.03725542749932994 inhibition 0.034575180916644334 synthesized 0.016617528812650766 development 0.012061109622085233 potent 0.005360493165371214 including 0.0021441972661484857 modeler 0.0
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