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Application

Discovery Studio 1.0 Materials Studio 0.5317754345967513 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06952869808679421 Amorphous Cell 0.15865608959402708 CASTEP 0.3261782547830145 CDOCKER 0.17452169855342978 CHARMm 0.3023798413439104 COMPASS 0.23005132991133925 COMPASS III 0.03173121791880541 COSMObase 9.332711152589828E-4 COSMOconf 9.332711152589828E-4 COSMOperm 0.0 COSMOquick 4.666355576294914E-4 COSMOtherm 0.03873075128324778 Catalyst 0.10545963602426504 Classical Simulations 0.7372841810545964 Conformers 0.0 Crystallization 0.03546430237984134 DFTB Plus 0.0032664489034064394 DMol3 0.1353243117125525 DPD 0.0 Discover 0.0018665422305179655 Forcite 0.2967802146523565 GULP 0.01773215118992067 LUDI 0.004199720018665422 LibDock 0.0867942137190854 LigandFit 0.0027998133457769483 MCSS 0.0 MODELER 0.2538497433504433 Mesocite 9.332711152589828E-4 Mesoscale 9.332711152589828E-4 Modules 0.0 Morphology 0.012132524498366775 Polymorph 9.332711152589828E-4 QMERA 0.0 QSAR 0.0018665422305179655 Quantum Mechanics 0.44797013532431174 Reflex 0.020998600093327113 Reflex Plus 0.0 Semi-empirical 0.005132991133924405 Sorption 0.026131591227251515 VAMP 9.332711152589828E-4 Visualization 1.0 X-Cell 4.666355576294914E-4 ZDOCK 0.028931404573028466

Year

2020 0.0 2021 0.26433313216656606 2022 0.28968014484007243 2023 0.5618587809293905 2024 1.0 2025 0.9118889559444779 2026 0.25709112854556426

Keywords

analysis 1.0 target 0.9444444444444444 docking 0.38173400673400676 potential 0.3672138047138047 visualization 0.2708333333333333 between 0.15298821548821548 binding 0.14225589225589225 novel 0.09154040404040405 protein 0.08080808080808081 interaction 0.0805976430976431 activity 0.06376262626262626 energy 0.05134680134680135 including 0.041666666666666664 silico 0.03535353535353535 stability 0.032407407407407406 promising 0.030723905723905723 drug 0.021254208754208755 experimental 0.018308080808080808 mechanism 0.015782828282828284 compound 0.013888888888888888 vitro 0.006734006734006734 cell 0.005050505050505051 treatment 0.004629629629629629 effective 0.0035774410774410776 development 0.0
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