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Application

Discovery Studio 0.9933614966807484 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057003654080389765 Amorphous Cell 0.27746650426309377 Blends 0.002679658952496955 CASTEP 0.32302070645554204 CDOCKER 0.1707673568818514 CHARMm 0.2686967113276492 COMPASS 0.3376370280146163 COMPASS III 0.10889159561510353 COSMObase 0.0048721071863581 COSMOconf 0.00535931790499391 COSMOmic 0.0 COSMOperm 4.8721071863581E-4 COSMOplex 2.43605359317905E-4 COSMOquick 4.8721071863581E-4 COSMOtherm 0.06479902557856272 Catalyst 0.07965895249695493 Classical Simulations 1.0 Conformers 4.8721071863581E-4 Crystallization 0.0730816077953715 DFTB Plus 0.00438489646772229 DMol3 0.14494518879415347 DPD 0.00243605359317905 Discover 0.00341047503045067 Forcite 0.5244823386114494 GULP 0.017295980511571253 Kinetix 2.43605359317905E-4 LUDI 0.0036540803897685747 LibDock 0.07088915956151036 LigandFit 0.00389768574908648 MODELER 0.25018270401948844 MesoDyn 0.0 Mesocite 0.00341047503045067 Mesoscale 0.005602923264311815 Modules 0.0 Morphology 0.016321559074299635 ONETEP 9.7442143727162E-4 Polymorph 0.002679658952496955 QMERA 2.43605359317905E-4 QSAR 0.0 Quantum Mechanics 0.46065773447015834 Reflex 0.05261875761266748 Reflex Plus 9.7442143727162E-4 Semi-empirical 0.00584652862362972 Sorption 0.059926918392204626 Synthia 0.001218026796589525 TURBOMOLE 2.43605359317905E-4 VAMP 7.30816077953715E-4 Visualization 0.689890377588307 X-Cell 0.001218026796589525 ZDOCK 0.02777101096224117

Year

2023 0.0 2024 0.32820019249278154 2025 1.0 2026 0.7355149181905678 2027 0.0011549566891241579

Keywords

target 1.0 potential 0.3089049338146811 docking 0.22154031287605294 analysis 0.22117930204572803 visualization 0.1624548736462094 between 0.1417569193742479 novel 0.09229843561973526 promising 0.08904933814681107 energy 0.07460890493381468 binding 0.07160048134777376 cell 0.062214199759326114 activity 0.04885679903730445 stability 0.0421179302045728 performance 0.04091456077015644 including 0.023104693140794223 effective 0.01696750902527076 development 0.016245487364620937 synthesized 0.015764139590854393 enhanced 0.014560770156438026 mechanism 0.013598074608904933 strong 0.012755716004813478 experimental 0.011672683513838749 interaction 0.007220216606498195 strategy 7.220216606498195E-4 protein 0.0
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