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Application

Discovery Studio 1.0 Materials Studio 0.993754078493521 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06423673763984121 Amorphous Cell 0.277878022374594 Blends 0.0022855768074100807 CASTEP 0.3753157704799711 CDOCKER 0.16660651990857692 CHARMm 0.26368338746541564 COMPASS 0.3504150126308192 COMPASS III 0.09082160471550584 COSMObase 0.00408997955010225 COSMOconf 0.004811740647179117 COSMOmic 1.2029351617947793E-4 COSMOperm 0.001323228677974257 COSMOplex 1.2029351617947793E-4 COSMOquick 0.0015638157103332131 COSMOtherm 0.06315409599422592 Cantera 0.0 Catalyst 0.11139179598219656 Classical Simulations 1.0 Conformers 7.217610970768675E-4 Crystallization 0.07133405509443042 DFTB Plus 0.005292914711897028 DMol3 0.16720798748947432 DPD 0.0022855768074100807 Discover 0.003608805485384338 Forcite 0.5333814507398051 GULP 0.022254300493203417 Kinetix 2.4058703235895585E-4 LUDI 0.003608805485384338 LibDock 0.07073258751353302 LigandFit 0.004210273066281727 MCSS 4.811740647179117E-4 MODELER 0.21352099121857332 MesoDyn 7.217610970768675E-4 Mesocite 0.003007337904486948 Mesoscale 0.005653795260435463 Modules 0.0 Morphology 0.01684109226512691 ONETEP 0.0010826416456153013 Polymorph 0.002044989775051125 QMERA 1.2029351617947793E-4 QSAR 9.623481294358234E-4 Quantum Mechanics 0.5315770479971129 Reflex 0.05172621195717551 Reflex Plus 0.0010826416456153013 Semi-empirical 0.006736436906050764 Sorption 0.05629736557199567 Synthia 0.0012029351617947792 TURBOMOLE 3.6088054853843375E-4 VAMP 0.0010826416456153013 Visualization 0.80416215565981 X-Cell 0.0015638157103332131 ZDOCK 0.027547215205100443

Year

2022 0.0 2023 0.24489608239838145 2024 0.47995217951075964 2025 1.0 2026 0.3915762368953467 2027 7.356998344675372E-4

Keywords

target 1.0 potential 0.2951226084613312 docking 0.2262462947992455 analysis 0.20312584209108056 visualization 0.1978981406628941 between 0.15305847480463486 novel 0.10288331985987605 energy 0.08526003772568042 binding 0.07394233360280247 promising 0.0691457828078685 cell 0.06289409862570736 activity 0.054324979789814064 stability 0.0391269199676637 performance 0.032983023443815686 interaction 0.031204527081649152 synthesized 0.028509835623821072 experimental 0.024898949070331446 effective 0.020156292104554028 including 0.020048504446240907 development 0.01983292912961466 mechanism 0.018970627863109674 protein 0.016599299380220964 synthesis 0.009862570735650769 design 0.0017784963621665319 enhanced 0.0
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