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Application

Discovery Studio 1.0 Materials Studio 0.6033439031421158 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07771326485037963 Amorphous Cell 0.3023671281822242 Blends 0.005806163465832961 CASTEP 0.1558731576596695 CDOCKER 0.18445734702992408 CHARMm 0.3318445734702992 COMPASS 0.37874050915587315 COMPASS III 0.06252791424743188 COSMObase 0.001786511835640911 COSMOconf 0.0026797677534613666 COSMOmic 4.4662795891022776E-4 COSMOperm 4.4662795891022776E-4 COSMOplex 0.0 COSMOquick 8.932559178204555E-4 COSMOtherm 0.04689593568557392 Catalyst 0.10674408217954444 Classical Simulations 1.0 Conformers 4.4662795891022776E-4 Crystallization 0.036176864671728454 DFTB Plus 0.009379187137114784 DMol3 0.14560071460473425 DPD 0.0026797677534613666 Discover 0.004912907548012505 Forcite 0.507815989280929 GULP 0.01027244305493524 LUDI 0.007146047342563644 LibDock 0.07592675301473872 LigandFit 0.0031263957123715946 MCSS 4.4662795891022776E-4 MODELER 0.21616793211255025 MesoDyn 8.932559178204555E-4 Mesocite 0.006699419383653417 Mesoscale 0.008485931219294328 Morphology 0.012952210808396605 ONETEP 0.0013398838767306833 Polymorph 8.932559178204555E-4 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.2876284055381867 Reflex 0.022331397945511387 Reflex Plus 0.0 Semi-empirical 0.011612326931665922 Sorption 0.05180884323358642 Synthia 8.932559178204555E-4 TURBOMOLE 0.0 VAMP 0.0013398838767306833 Visualization 0.9325591782045556 X-Cell 0.0 ZDOCK 0.05180884323358642

Year

2021 0.09637305699481866 2022 0.3373056994818653 2023 0.5492227979274611 2024 1.0 2025 0.8564766839378238 2026 0.2077720207253886 2027 0.0

Keywords

interaction 1.0 target 0.9559735841504903 between 0.4104462677606564 docking 0.3496097658595157 potential 0.2919751851110666 analysis 0.2633580148088853 visualization 0.24334600760456274 binding 0.20892535521312788 energy 0.10706423854312587 protein 0.09745847508505102 mechanism 0.09165499299579748 cell 0.06583950370222133 novel 0.06523914348609165 stability 0.046427856714028416 activity 0.04182509505703422 experimental 0.031218731238743247 drug 0.025815489293576147 complex 0.02221332799679808 including 0.017010206123674206 effective 0.013207924754852912 silico 0.01280768461076646 development 0.011206724034420652 strong 0.00840504302581549 promising 0.004802881729037423 role 0.0
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