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Application

Discovery Studio 1.0 Materials Studio 0.015097338100913786 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.004765308553728854 Amorphous Cell 0.002144388849177984 CASTEP 0.0014295925661186562 CDOCKER 0.20061949011198474 CHARMm 0.3333333333333333 COMPASS 0.005956635692161067 COMPASS III 0.0019061234214915416 COSMOperm 0.0 COSMOtherm 9.530617107457708E-4 Catalyst 0.16940671908506075 Classical Simulations 0.34977364784369785 Crystallization 0.0016678579938050988 DMol3 0.007862759113652609 Forcite 0.009530617107457708 LUDI 0.004765308553728854 LibDock 0.08577555396711938 LigandFit 0.004050512270669526 MCSS 2.382654276864427E-4 MODELER 0.24755777936621395 Polymorph 0.0 QSAR 4.765308553728854E-4 Quantum Mechanics 0.009530617107457708 Reflex 0.0014295925661186562 Sorption 4.765308553728854E-4 Visualization 1.0 X-Cell 4.765308553728854E-4 ZDOCK 0.0245413390517036

Year

2022 0.0 2023 0.6237277353689568 2024 1.0 2025 0.7490458015267175 2026 0.0

Keywords

docking 1.0 target 0.966182804275004 potential 0.4933801244217579 visualization 0.44791832828202266 analysis 0.35571861540915617 binding 0.3011644600414739 activity 0.1748285212952624 protein 0.1580794385069389 novel 0.1494656245015154 silico 0.125857393523688 vitro 0.11182006699633115 compound 0.09937789121071941 drug 0.08550007975753708 between 0.08246929334822141 inhibition 0.07321741904609985 synthesis 0.07178178337852927 promising 0.067315361301643 interaction 0.06316796937310576 synthesized 0.06268942415058223 therapeutic 0.05933960759291753 treatment 0.029510288722284256 including 0.017227628010847026 potent 0.011485085340564683 stability 0.004466422076886266 development 0.0
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