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Application

Discovery Studio 0.9405251951738822 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06350895866595707 Amorphous Cell 0.28188752882739043 Blends 0.0017739932588256165 CASTEP 0.34344509490863934 CDOCKER 0.15965939329430548 CHARMm 0.2595352137661877 COMPASS 0.3459286854709952 COMPASS III 0.10147241440482527 COSMObase 0.004612382472946603 COSMOconf 0.005676778428241973 COSMOmic 0.0 COSMOperm 5.321979776476849E-4 COSMOplex 1.7739932588256165E-4 COSMOquick 0.0014191946070604932 COSMOtherm 0.0656377505765478 Catalyst 0.08390988114245165 Classical Simulations 1.0 Conformers 3.547986517651233E-4 Crystallization 0.07184672698243746 DFTB Plus 0.004080184495298918 DMol3 0.15557920879900655 DPD 0.0023061912364733014 Discover 0.0037253858435337944 Forcite 0.5345041688841582 GULP 0.019691325172964343 Kinetix 1.7739932588256165E-4 LUDI 0.003547986517651233 LibDock 0.06741174383537342 LigandFit 0.004080184495298918 MCSS 5.321979776476849E-4 MODELER 0.24215007982969664 MesoDyn 7.095973035302466E-4 Mesocite 0.0031931878658861094 Mesoscale 0.005854177754124534 Modules 0.0 Morphology 0.016675536632960796 ONETEP 8.869966294128083E-4 Polymorph 0.0017739932588256165 QMERA 1.7739932588256165E-4 QSAR 5.321979776476849E-4 Quantum Mechanics 0.48962213943587013 Reflex 0.052155401809473124 Reflex Plus 8.869966294128083E-4 Semi-empirical 0.005499379102359411 Sorption 0.054284193720063864 Synthia 0.0010643959552953698 TURBOMOLE 1.7739932588256165E-4 VAMP 8.869966294128083E-4 Visualization 0.6957601561114067 X-Cell 0.0017739932588256165 ZDOCK 0.027674294837679615

Year

2023 0.021030640668523677 2024 0.44958217270194983 2025 1.0 2026 0.5896935933147632 2027 0.0

Keywords

target 1.0 potential 0.295807056417249 docking 0.2083688426793932 analysis 0.20726095108232487 visualization 0.16217828532469747 between 0.15024714504857678 novel 0.09178455769558548 energy 0.08130219873870803 promising 0.07806374637804671 binding 0.06775183228225669 cell 0.06136014999147776 activity 0.04167376853587864 stability 0.041503323674791204 performance 0.04048065450826657 including 0.020794273052667463 effective 0.017555820692006136 experimental 0.015936594511675475 synthesized 0.015595704789500597 interaction 0.013039031873189024 development 0.01244247485938299 mechanism 0.012186807567751833 enhanced 0.008948355207090506 strong 0.003323674791205045 protein 0.0011931140276120675 design 0.0
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