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Application

Discovery Studio 1.0 Materials Studio 0.8196990424076608 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0533033033033033 Amorphous Cell 0.26463963963963966 Blends 0.0011261261261261261 CASTEP 0.28003003003003 CDOCKER 0.19707207207207209 CHARMm 0.30855855855855857 COMPASS 0.3171921921921922 COMPASS III 0.1111111111111111 COSMObase 0.00487987987987988 COSMOconf 0.006006006006006006 COSMOmic 0.0 COSMOperm 3.7537537537537537E-4 COSMOplex 3.7537537537537537E-4 COSMOquick 7.507507507507507E-4 COSMOtherm 0.06043543543543543 Catalyst 0.08596096096096097 Classical Simulations 1.0 Conformers 3.7537537537537537E-4 Crystallization 0.07132132132132132 DFTB Plus 0.0045045045045045045 DMol3 0.13288288288288289 DPD 0.003003003003003003 Discover 0.004129129129129129 Forcite 0.4966216216216216 GULP 0.01463963963963964 Kinetix 0.0 LUDI 0.003003003003003003 LibDock 0.07695195195195195 LigandFit 0.0045045045045045045 MODELER 0.27927927927927926 Mesocite 0.0037537537537537537 Mesoscale 0.006006006006006006 Morphology 0.015765765765765764 ONETEP 0.0011261261261261261 Polymorph 0.002627627627627628 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.408033033033033 Reflex 0.051426426426426426 Reflex Plus 7.507507507507507E-4 Semi-empirical 0.005255255255255256 Sorption 0.05780780780780781 Synthia 0.0011261261261261261 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7755255255255256 X-Cell 7.507507507507507E-4 ZDOCK 0.03078078078078078

Year

2024 0.2704819277108434 2025 1.0 2026 0.8753012048192771 2027 0.0

Keywords

target 1.0 potential 0.33065839868685026 docking 0.25898230895495167 analysis 0.23363122378260076 visualization 0.1907714754696334 between 0.12985591829290535 promising 0.0917380995805216 binding 0.0913733357650921 novel 0.08900237096480029 activity 0.05945650191501003 energy 0.05526171803757067 cell 0.051431697975560825 stability 0.03483494437351815 including 0.027722049972642715 performance 0.017691045048331206 strong 0.01750866314061645 development 0.013313879263177094 synthesized 0.012949115447747583 effective 0.012766733540032828 mechanism 0.007112894400875433 protein 0.007112894400875433 therapeutic 0.006383366770016414 interaction 0.0032828743388655843 strategy 0.0014590552617180376 enhanced 0.0
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