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Application

Discovery Studio 1.0 Materials Studio 0.9702836560108059 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06431020215155456 Amorphous Cell 0.2784017023288805 Blends 0.002127911100602908 CASTEP 0.3680104031209363 CDOCKER 0.16775032509752927 CHARMm 0.26705284312566496 COMPASS 0.35169641801631396 COMPASS III 0.0883083106750207 COSMObase 0.003664735784371675 COSMOconf 0.004610474051306301 COSMOmic 1.1821728336682824E-4 COSMOperm 0.0013003901170351106 COSMOplex 1.1821728336682824E-4 COSMOquick 0.0014186074004019387 COSMOtherm 0.06300981203451944 Cantera 0.0 Catalyst 0.11762619694999409 Classical Simulations 1.0 Conformers 5.910864168341412E-4 Crystallization 0.07187610828703156 DFTB Plus 0.005083343184773614 DMol3 0.1653859794301927 DPD 0.002600780234070221 Discover 0.003546518501004847 Forcite 0.5304409504669583 GULP 0.021515545572762737 Kinetix 1.1821728336682824E-4 LUDI 0.004374039484572645 LibDock 0.07057571816999646 LigandFit 0.004965125901406786 MCSS 5.910864168341412E-4 MODELER 0.21208180636008986 MesoDyn 8.275209835677976E-4 Mesocite 0.0031918666509043623 Mesoscale 0.006147298735075068 Modules 0.0 Morphology 0.01749615793829058 ONETEP 0.0011821728336682824 Polymorph 0.0017732592505024234 QMERA 1.1821728336682824E-4 QSAR 9.457382669346259E-4 Quantum Mechanics 0.523111478898215 Reflex 0.05189738739803759 Reflex Plus 0.001063955550301454 Semi-empirical 0.0067383851519092096 Sorption 0.05662607873271072 Synthia 0.0011821728336682824 TURBOMOLE 4.7286913346731294E-4 VAMP 0.0013003901170351106 Visualization 0.8187729045986524 X-Cell 0.0014186074004019387 ZDOCK 0.028135713441305117

Year

2022 0.01632537510616212 2023 0.27554968387279416 2024 0.5232613003680286 2025 1.0 2026 0.4011512692271398 2027 0.0

Keywords

target 1.0 potential 0.2931819371042855 docking 0.2295013343100832 visualization 0.20349536915912303 analysis 0.20218722201873265 between 0.15321019308251793 novel 0.10418083826068757 energy 0.08487258646852598 binding 0.07738998482549317 promising 0.06776202187222019 cell 0.06472712050651458 activity 0.058238710690178434 stability 0.03997697661032913 interaction 0.03453508450630527 synthesized 0.03160483491183088 performance 0.031238553712521586 experimental 0.027000156977656845 including 0.02187222018732667 development 0.021662916644864215 mechanism 0.0216105907592486 effective 0.021558264873632986 protein 0.02098268013186123 synthesis 0.013343100831981581 design 0.004447700277327194 enhanced 0.0
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