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Application

Discovery Studio 0.9825474072831012 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06394389438943894 Amorphous Cell 0.2786716171617162 Blends 0.0016501650165016502 CASTEP 0.33374587458745875 CDOCKER 0.16501650165016502 CHARMm 0.26732673267326734 COMPASS 0.3448844884488449 COMPASS III 0.09962871287128713 COSMObase 0.004744224422442244 COSMOconf 0.005775577557755775 COSMOmic 0.0 COSMOperm 6.188118811881188E-4 COSMOplex 2.0627062706270627E-4 COSMOquick 0.0016501650165016502 COSMOtherm 0.06373762376237624 Catalyst 0.08168316831683169 Classical Simulations 1.0 Conformers 2.0627062706270627E-4 Crystallization 0.07095709570957096 DFTB Plus 0.003919141914191419 DMol3 0.1520214521452145 DPD 0.002268976897689769 Discover 0.004125412541254125 Forcite 0.5290841584158416 GULP 0.018976897689768978 Kinetix 0.0 LUDI 0.004125412541254125 LibDock 0.07075082508250825 LigandFit 0.0037128712871287127 MCSS 6.188118811881188E-4 MODELER 0.2545379537953795 MesoDyn 6.188118811881188E-4 Mesocite 0.0035066006600660065 Mesoscale 0.005981848184818482 Morphology 0.015676567656765675 ONETEP 6.188118811881188E-4 Polymorph 0.0018564356435643563 QMERA 2.0627062706270627E-4 QSAR 6.188118811881188E-4 Quantum Mechanics 0.4768976897689769 Reflex 0.05218646864686469 Reflex Plus 8.250825082508251E-4 Semi-empirical 0.005363036303630363 Sorption 0.05363036303630363 Synthia 8.250825082508251E-4 TURBOMOLE 2.0627062706270627E-4 VAMP 8.250825082508251E-4 Visualization 0.7037953795379538 X-Cell 0.0016501650165016502 ZDOCK 0.028465346534653466

Year

2023 9.83445336830028E-4 2024 0.41829208326503853 2025 1.0 2026 0.669726274381249 2027 0.0

Keywords

target 1.0 potential 0.30644196250498607 docking 0.2184882329477463 analysis 0.216094934184284 visualization 0.16523733546071 between 0.14938173115277223 novel 0.09373753490227363 promising 0.08177104108496211 energy 0.07678500199441564 binding 0.07439170323095333 cell 0.06033107299561229 activity 0.0447746310331073 stability 0.04098524132429198 performance 0.035700039888312725 including 0.023234942161946548 effective 0.017052253689668926 synthesized 0.013462305544475469 development 0.012066214599122457 interaction 0.011467889908256881 mechanism 0.011467889908256881 experimental 0.010869565217391304 strong 0.009274032708416435 enhanced 0.008875149581172716 protein 0.003689668927004388 design 0.0
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