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Application

Discovery Studio 0.9775168623532351 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06618205489855701 Amorphous Cell 0.2785071064337637 Blends 0.002495388955191494 CASTEP 0.3840729087555604 CDOCKER 0.1630682434631659 CHARMm 0.25604860583704026 COMPASS 0.3578170771400673 COMPASS III 0.08723011825973744 COSMObase 0.003797331018769665 COSMOconf 0.004556797222523598 COSMOmic 1.0849517196484756E-4 COSMOperm 0.0013019420635781707 COSMOplex 2.1699034392969513E-4 COSMOquick 0.001518932407507866 COSMOtherm 0.06422914180318975 Cantera 0.0 Catalyst 0.11543886297059781 Classical Simulations 1.0 Conformers 6.509710317890853E-4 Crystallization 0.0732342410762721 DFTB Plus 0.005750244114136921 DMol3 0.17239882825214278 DPD 0.002495388955191494 Discover 0.0033633503309102746 Forcite 0.5361831398502767 GULP 0.023434957144407072 Kinetix 2.1699034392969513E-4 LUDI 0.0036888358468048174 LibDock 0.07008788108929152 LigandFit 0.004773787566453293 MCSS 5.424758598242378E-4 MODELER 0.19670174677226862 MesoDyn 9.76456547683628E-4 Mesocite 0.003471845502875122 Mesoscale 0.0065097103178908535 Modules 0.0 Morphology 0.017142237170445915 ONETEP 0.0010849517196484756 Polymorph 0.0020614082673321038 QMERA 1.0849517196484756E-4 QSAR 0.0010849517196484756 Quantum Mechanics 0.5448627536074645 Reflex 0.053379624606705 Reflex Plus 9.76456547683628E-4 Semi-empirical 0.00759466203753933 Sorption 0.05706846045350982 Synthia 0.001518932407507866 TURBOMOLE 5.424758598242378E-4 VAMP 0.001518932407507866 Visualization 0.8099164587175871 X-Cell 0.0014104372355430183 ZDOCK 0.028208744710860368

Year

2022 0.02784697508896797 2023 0.30258007117437724 2024 0.5631672597864769 2025 1.0 2026 0.3781138790035587 2027 0.0

Keywords

target 1.0 potential 0.2884948096885813 docking 0.22217416378316032 visualization 0.20136485966935794 analysis 0.1986735870818916 between 0.1566705113417916 novel 0.10380622837370242 energy 0.08962898885044214 binding 0.073000768935025 promising 0.06651287966166859 cell 0.0654555940023068 activity 0.05464244521337947 stability 0.041089965397923874 interaction 0.03580353710111495 performance 0.03373702422145329 synthesized 0.03200692041522491 experimental 0.03128604382929642 development 0.02239523260284506 effective 0.022202998846597464 mechanism 0.02181853133410227 including 0.02090542099192618 protein 0.01845444059976932 synthesis 0.014513648596693579 design 0.004709727028066129 chemical 0.0
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