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Application

Discovery Studio 0.7183975106962271 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06534653465346535 Amorphous Cell 0.30297029702970296 Blends 0.0019801980198019802 CASTEP 0.31732673267326733 CDOCKER 0.13316831683168318 CHARMm 0.20544554455445543 COMPASS 0.3668316831683168 COMPASS III 0.12178217821782178 COSMObase 0.0039603960396039604 COSMOconf 0.006930693069306931 COSMOmic 0.0 COSMOperm 9.900990099009901E-4 COSMOplex 4.950495049504951E-4 COSMOquick 0.0 COSMOtherm 0.06831683168316832 Catalyst 0.060396039603960394 Classical Simulations 1.0 Conformers 4.950495049504951E-4 Crystallization 0.08564356435643565 DFTB Plus 0.0029702970297029703 DMol3 0.14207920792079207 DPD 0.0029702970297029703 Discover 0.0049504950495049506 Forcite 0.5707920792079207 GULP 0.01287128712871287 Kinetix 0.0 LUDI 9.900990099009901E-4 LibDock 0.05396039603960396 LigandFit 0.0019801980198019802 MODELER 0.19455445544554456 Mesocite 0.004455445544554455 Mesoscale 0.006930693069306931 Morphology 0.019306930693069307 ONETEP 9.900990099009901E-4 Polymorph 0.0014851485148514852 QMERA 0.0 Quantum Mechanics 0.453960396039604 Reflex 0.06287128712871287 Reflex Plus 4.950495049504951E-4 Semi-empirical 0.004455445544554455 Sorption 0.06188118811881188 Synthia 9.900990099009901E-4 TURBOMOLE 0.0 VAMP 4.950495049504951E-4 Visualization 0.5712871287128712 X-Cell 9.900990099009901E-4 ZDOCK 0.02178217821782178

Year

2025 0.7806855879100627 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.28917339270804343 analysis 0.20790425827998887 docking 0.16782632897300306 between 0.13943779571388812 visualization 0.13470637350403564 energy 0.08989702198719733 promising 0.08794878931255218 cell 0.0801558586139716 novel 0.07959922070693014 performance 0.0768160311717228 binding 0.04898413581964932 stability 0.04787086000556638 strategy 0.035346507097133315 activity 0.031171722794322294 strong 0.03089340384080156 enhanced 0.030336765933760088 including 0.020873921514055108 mechanism 0.02031728360701364 effective 0.013915947676036738 development 0.01224603395491233 design 0.01168939604787086 experimental 0.008071249652101308 synthesized 0.007236292791539103 efficient 0.0
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