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Application

Discovery Studio 0.8679417122040073 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06343656343656344 Amorphous Cell 0.29087579087579085 Blends 0.001998001998001998 CASTEP 0.3546453546453546 CDOCKER 0.15417915417915418 CHARMm 0.24358974358974358 COMPASS 0.35614385614385613 COMPASS III 0.10173160173160173 COSMObase 0.004495504495504496 COSMOconf 0.005661005661005661 COSMOmic 0.0 COSMOperm 4.995004995004995E-4 COSMOplex 1.665001665001665E-4 COSMOquick 0.001665001665001665 COSMOtherm 0.0661005661005661 Catalyst 0.07708957708957709 Classical Simulations 1.0 Conformers 3.33000333000333E-4 Crystallization 0.07292707292707293 DFTB Plus 0.004495504495504496 DMol3 0.15950715950715952 DPD 0.0021645021645021645 Discover 0.003663003663003663 Forcite 0.5466200466200466 GULP 0.02047952047952048 Kinetix 1.665001665001665E-4 LUDI 0.00333000333000333 LibDock 0.06543456543456544 LigandFit 0.003663003663003663 MCSS 3.33000333000333E-4 MODELER 0.2321012321012321 MesoDyn 6.66000666000666E-4 Mesocite 0.0031635031635031635 Mesoscale 0.005661005661005661 Modules 0.0 Morphology 0.016650016650016652 ONETEP 8.325008325008325E-4 Polymorph 0.001998001998001998 QMERA 1.665001665001665E-4 QSAR 6.66000666000666E-4 Quantum Mechanics 0.5041625041625042 Reflex 0.05311355311355311 Reflex Plus 9.99000999000999E-4 Semi-empirical 0.005994005994005994 Sorption 0.05710955710955711 Synthia 9.99000999000999E-4 TURBOMOLE 3.33000333000333E-4 VAMP 9.99000999000999E-4 Visualization 0.6626706626706627 X-Cell 0.0014985014985014985 ZDOCK 0.026973026973026972

Year

2023 0.0016522623284189121 2024 0.43632435180477885 2025 1.0 2026 0.53978139298424 2027 0.0

Keywords

target 1.0 potential 0.2917066155321189 analysis 0.20773410035155002 docking 0.1958293384467881 between 0.15691914349632471 visualization 0.15404282518376478 novel 0.09643656120166187 energy 0.09356024288910195 promising 0.08181527644614893 cell 0.07086928731224033 binding 0.0643975711089805 performance 0.052972195589645256 stability 0.045461808884627676 activity 0.043064876957494405 experimental 0.025167785234899327 including 0.023969319271332695 effective 0.022131671460530522 mechanism 0.01973473953339725 synthesized 0.019654841802492808 development 0.01829658037711729 enhanced 0.01805688718440396 interaction 0.01621923937360179 strong 0.007110898050495366 design 0.00551294343240652 protein 0.0
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