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Application

Discovery Studio 1.0 Materials Studio 0.012786596119929453 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.003472222222222222 Amorphous Cell 0.001736111111111111 CASTEP 8.680555555555555E-4 CDOCKER 0.2361111111111111 CHARMm 0.3897569444444444 COMPASS 0.005208333333333333 COMPASS III 0.003472222222222222 COSMOtherm 8.680555555555555E-4 Catalyst 0.13802083333333334 Classical Simulations 0.4079861111111111 Crystallization 0.001736111111111111 DMol3 0.006944444444444444 Forcite 0.011284722222222222 LUDI 0.004340277777777778 LibDock 0.1032986111111111 LigandFit 0.0026041666666666665 MODELER 0.3532986111111111 Polymorph 0.0 Quantum Mechanics 0.008680555555555556 Reflex 8.680555555555555E-4 Sorption 0.001736111111111111 Visualization 1.0 ZDOCK 0.028645833333333332

Year

2024 0.5998568360773086 2025 1.0 2026 0.0

Keywords

docking 1.0 target 0.971211298207496 potential 0.5415535035306899 analysis 0.39054861488321563 visualization 0.3780554046713743 binding 0.31233025529603475 activity 0.17110266159695817 novel 0.14557305812058663 protein 0.12819120043454643 silico 0.12058663769690385 promising 0.11135252580119501 vitro 0.10483432916892993 therapeutic 0.09885931558935361 inhibition 0.08908202064095601 between 0.08039109179793591 compound 0.060293318848451925 drug 0.044541010320478004 synthesis 0.042911461162411735 synthesized 0.035850081477457905 including 0.03476371537208039 interaction 0.02933188484519283 potent 0.00977729494839761 treatment 0.007061379684953829 stability 0.0038022813688212928 strong 0.0
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