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Application

Discovery Studio 1.0 Materials Studio 0.8669293725371324 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05317460317460317 Amorphous Cell 0.2702380952380952 Blends 7.936507936507937E-4 CASTEP 0.28095238095238095 CDOCKER 0.1869047619047619 CHARMm 0.29642857142857143 COMPASS 0.32301587301587303 COMPASS III 0.1126984126984127 COSMObase 0.005158730158730159 COSMOconf 0.006349206349206349 COSMOmic 0.0 COSMOperm 3.968253968253968E-4 COSMOplex 3.968253968253968E-4 COSMOquick 7.936507936507937E-4 COSMOtherm 0.06111111111111111 Catalyst 0.08333333333333333 Classical Simulations 1.0 Conformers 3.968253968253968E-4 Crystallization 0.07103174603174603 DFTB Plus 0.0035714285714285713 DMol3 0.13333333333333333 DPD 0.002380952380952381 Discover 0.004365079365079365 Forcite 0.5067460317460317 GULP 0.013888888888888888 Kinetix 0.0 LUDI 0.002777777777777778 LibDock 0.07222222222222222 LigandFit 0.003968253968253968 MODELER 0.2722222222222222 Mesocite 0.003968253968253968 Mesoscale 0.005555555555555556 Morphology 0.01626984126984127 ONETEP 0.0011904761904761906 Polymorph 0.002380952380952381 QMERA 0.0 Quantum Mechanics 0.4091269841269841 Reflex 0.050793650793650794 Reflex Plus 7.936507936507937E-4 Semi-empirical 0.004365079365079365 Sorption 0.05952380952380952 Synthia 7.936507936507937E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7416666666666667 X-Cell 7.936507936507937E-4 ZDOCK 0.02896825396825397

Year

2024 0.1717676452217364 2025 1.0 2026 0.8931917551530294 2027 0.0

Keywords

target 1.0 potential 0.3273302988323768 docking 0.2491589154957451 analysis 0.23174351870176133 visualization 0.18187215515535327 between 0.13002176924599249 promising 0.09103502869582426 binding 0.08648327726103305 novel 0.08430635266178507 energy 0.06154759548782901 cell 0.05600633287156145 activity 0.05402731050860875 stability 0.03483079358796754 including 0.02830001979022363 performance 0.023154561646546605 strong 0.019592321393231745 effective 0.012269938650306749 synthesized 0.010686720759944587 development 0.010290916287354047 mechanism 0.006728676034039185 strategy 0.005937067088858104 therapeutic 0.005343360379972293 protein 0.002968533544429052 enhanced 0.0019790223629527013 interaction 0.0
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