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Application

Discovery Studio 0.8388818297331639 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06593760051463493 Amorphous Cell 0.2933419105821808 Blends 0.002251527822450949 CASTEP 0.33740752653586364 CDOCKER 0.14956577677709876 CHARMm 0.2306207783853329 COMPASS 0.35284657446124157 COMPASS III 0.10968156963653908 COSMObase 0.0041814088131231905 COSMOconf 0.0077195239626889674 COSMOmic 0.0 COSMOperm 3.21646831778707E-4 COSMOplex 0.0 COSMOquick 3.21646831778707E-4 COSMOtherm 0.07140559665487295 Catalyst 0.07526535863621743 Classical Simulations 1.0 Conformers 3.21646831778707E-4 Crystallization 0.07494371180443872 DFTB Plus 0.0038597619813444837 DMol3 0.151495657767771 DPD 0.002251527822450949 Discover 0.002894821486008363 Forcite 0.5548407848182696 GULP 0.01608234158893535 Kinetix 3.21646831778707E-4 LUDI 0.0038597619813444837 LibDock 0.05821807655194596 LigandFit 0.003538115149565777 MCSS 3.21646831778707E-4 MODELER 0.22386619491798007 MesoDyn 0.0 Mesocite 0.0032164683177870698 Mesoscale 0.005789642972016726 Morphology 0.0183338694113863 ONETEP 0.0016082341588935349 Polymorph 6.43293663557414E-4 QMERA 0.0 QSAR 3.21646831778707E-4 Quantum Mechanics 0.4834351881633966 Reflex 0.05371502090704407 Reflex Plus 0.0 Semi-empirical 0.005789642972016726 Sorption 0.05853972338372467 Synthia 9.649404953361209E-4 TURBOMOLE 6.43293663557414E-4 VAMP 0.001286587327114828 Visualization 0.6323576712769379 X-Cell 0.001286587327114828 ZDOCK 0.025731746542296558

Year

2023 0.0 2024 0.3829953198127925 2025 1.0 2026 0.6765470618824753 2027 0.0026001040041601664

Keywords

target 1.0 potential 0.2799301365512861 analysis 0.19815814544299779 docking 0.1867259447443633 between 0.14607812003810733 visualization 0.14083836138456654 energy 0.08177199110828834 novel 0.08161321054302953 promising 0.07669101302000635 cell 0.06986344871387742 performance 0.055096856144807874 binding 0.05335026992696094 stability 0.03763099396633852 activity 0.03715465227056208 experimental 0.021435376309939663 enhanced 0.0193712289615751 mechanism 0.01762464274372817 effective 0.016830739917434105 synthesized 0.016671959352175292 development 0.0115909812638933 including 0.011273420133375674 strong 0.0057161003493172435 design 0.0036519530009526836 strategy 0.00206414734836456 interaction 0.0
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