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Application

Discovery Studio 1.0 Materials Studio 0.8704554951943168 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04866310160427807 Amorphous Cell 0.2711229946524064 Blends 0.0010695187165775401 CASTEP 0.26844919786096255 CDOCKER 0.18288770053475936 CHARMm 0.29251336898395724 COMPASS 0.3229946524064171 COMPASS III 0.11925133689839572 COSMObase 0.0042780748663101605 COSMOconf 0.008021390374331552 COSMOmic 0.0 COSMOperm 5.347593582887701E-4 COSMOplex 5.347593582887701E-4 COSMOtherm 0.06417112299465241 Catalyst 0.08128342245989305 Classical Simulations 1.0 Conformers 5.347593582887701E-4 Crystallization 0.07379679144385026 DFTB Plus 0.0037433155080213902 DMol3 0.12032085561497326 DPD 0.0016042780748663102 Discover 0.0037433155080213902 Forcite 0.5064171122994653 GULP 0.011764705882352941 Kinetix 0.0 LUDI 0.0021390374331550803 LibDock 0.0732620320855615 LigandFit 0.0037433155080213902 MODELER 0.2663101604278075 Mesocite 0.0042780748663101605 Mesoscale 0.0053475935828877 Morphology 0.017112299465240642 ONETEP 0.0010695187165775401 Polymorph 0.0021390374331550803 Quantum Mechanics 0.3850267379679144 Reflex 0.052941176470588235 Reflex Plus 0.0 Semi-empirical 0.0037433155080213902 Sorption 0.06149732620320856 Synthia 0.0010695187165775401 TURBOMOLE 0.0 Visualization 0.7262032085561497 X-Cell 5.347593582887701E-4 ZDOCK 0.03155080213903743

Year

2024 0.0 2025 1.0 2026 0.9284294234592445 2027 0.003976143141153081

Keywords

target 1.0 potential 0.3324353448275862 docking 0.24811422413793102 analysis 0.2260237068965517 visualization 0.1810344827586207 between 0.12365301724137931 promising 0.09644396551724138 novel 0.09132543103448276 binding 0.0894396551724138 energy 0.059267241379310345 activity 0.05872844827586207 cell 0.055765086206896554 stability 0.040140086206896554 including 0.03286637931034483 strong 0.03178879310344827 performance 0.03151939655172414 development 0.018588362068965518 therapeutic 0.018318965517241378 strategy 0.016433189655172414 effective 0.015894396551724137 mechanism 0.013469827586206896 enhanced 0.008351293103448275 synthesized 0.005926724137931034 interaction 8.081896551724138E-4 protein 0.0
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