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Application

Discovery Studio 0.8565384236937912 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06836707862214042 Amorphous Cell 0.29148041020247173 Blends 0.0024980278727320536 CASTEP 0.3910070996581646 CDOCKER 0.14935577175913753 CHARMm 0.2340257691296345 COMPASS 0.3706284512227189 COMPASS III 0.08992900341835393 COSMObase 0.0038127793846962923 COSMOconf 0.005259006047856955 COSMOmic 0.0 COSMOperm 9.203260583749671E-4 COSMOplex 2.6295030239284776E-4 COSMOquick 0.001183276360767815 COSMOtherm 0.06797265316855114 Cantera 0.0 Catalyst 0.10347094399158559 Classical Simulations 1.0 Conformers 5.259006047856955E-4 Crystallization 0.07507231133315803 DFTB Plus 0.005916381803839074 DMol3 0.17565080199842228 DPD 0.002892453326321325 Discover 0.004207204838285564 Forcite 0.5531159610833553 GULP 0.02235077570339206 Kinetix 2.6295030239284776E-4 LUDI 0.00407572968708914 LibDock 0.06258217196949777 LigandFit 0.00473310544307126 MCSS 3.944254535892716E-4 MODELER 0.18564291348935053 MesoDyn 9.203260583749671E-4 Mesocite 0.0035498290823034444 Mesoscale 0.006705232711017617 Modules 0.0 Morphology 0.017749145411517224 ONETEP 0.001183276360767815 Polymorph 0.001972127267946358 QMERA 2.6295030239284776E-4 QSAR 0.001051801209571391 Quantum Mechanics 0.5562713647120694 Reflex 0.05443071259531949 Reflex Plus 6.573757559821193E-4 Semi-empirical 0.007888509071785432 Sorption 0.05732316592164081 Synthia 0.0014462266631606626 TURBOMOLE 5.259006047856955E-4 VAMP 0.0014462266631606626 Visualization 0.7304759400473311 X-Cell 0.0014462266631606626 ZDOCK 0.027346831448856166

Year

2022 0.057603152526657396 2023 0.2409596662030598 2024 0.5768428372739917 2025 1.0 2026 0.49061196105702365 2027 0.0

Keywords

target 1.0 potential 0.2766819941916747 docking 0.19542594385285575 analysis 0.1925217812197483 visualization 0.17412875121006777 between 0.15876089060987417 energy 0.09632139399806389 novel 0.093054211035818 cell 0.06824782187802517 promising 0.06304453049370765 binding 0.06213697967086157 activity 0.04338092933204259 performance 0.04186834462729913 stability 0.04029525653436592 experimental 0.031098741529525655 synthesized 0.026318973862536302 interaction 0.026197967086156824 effective 0.020994675701839303 mechanism 0.018695546950629235 including 0.018030009680542112 development 0.016093901258470475 synthesis 0.004537754114230397 enhanced 0.003690706679574056 design 0.003267182962245886 protein 0.0
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