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Application

Discovery Studio 1.0 Materials Studio 0.983678955453149 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06757912745936698 Amorphous Cell 0.279213002566296 Blends 0.0024807527801539776 CASTEP 0.395295124037639 CDOCKER 0.1737382378100941 CHARMm 0.2594525235243798 COMPASS 0.3656116338751069 COMPASS III 0.07827202737382379 COSMObase 0.0032506415739948676 COSMOconf 0.0036783575705731392 COSMOmic 1.7108639863130882E-4 COSMOperm 0.0013686911890504706 COSMOplex 2.5662959794696324E-4 COSMOquick 0.0012831479897348161 COSMOtherm 0.0630453378956373 Cantera 0.0 Catalyst 0.12745936698032506 Classical Simulations 1.0 Conformers 8.55431993156544E-4 Crystallization 0.07390932420872541 DFTB Plus 0.005902480752780154 DMol3 0.17929854576561163 DPD 0.0030795551753635586 Discover 0.0036783575705731392 Forcite 0.5338751069289992 GULP 0.025491873396065012 Kinetix 2.5662959794696324E-4 LUDI 0.004875962360992301 LibDock 0.0710863986313088 LigandFit 0.00641573994867408 MCSS 0.001026518391787853 MODELER 0.18058169375534644 MesoDyn 0.0016253207869974338 Mesocite 0.004191616766467066 Mesoscale 0.007869974337040205 Modules 0.0 Morphology 0.017365269461077845 ONETEP 9.409751924721985E-4 Polymorph 0.001881950384944397 QMERA 2.5662959794696324E-4 QSAR 0.0011120615911035072 Quantum Mechanics 0.5639863130881095 Reflex 0.054234388366124896 Reflex Plus 7.698887938408897E-4 Semi-empirical 0.007869974337040205 Sorption 0.054063301967493586 Synthia 0.0014542343883661248 TURBOMOLE 5.988023952095808E-4 VAMP 0.0015397775876817793 Visualization 0.8616766467065868 X-Cell 0.0011976047904191617 ZDOCK 0.029940119760479042

Year

2021 0.04469371658925598 2022 0.2551047235124003 2023 0.3778809920252388 2024 0.8595215143282797 2025 1.0 2026 0.3725352729822102 2027 0.0

Keywords

target 1.0 potential 0.2704059202813599 docking 0.2199223329425557 visualization 0.21006740914419694 analysis 0.18511869871043377 between 0.15134085580304807 novel 0.10158997655334115 energy 0.08297919109026963 binding 0.07184202813599062 cell 0.06063159437280188 activity 0.051949003516998826 promising 0.04956770222743259 interaction 0.038430539273153576 stability 0.03168962485345838 synthesized 0.03033411488862837 experimental 0.027989449003517 performance 0.02091881594372802 protein 0.020186107854630715 effective 0.01908704572098476 mechanism 0.0180978898007034 development 0.017328546307151232 synthesis 0.01307883939038687 including 0.012639214536928487 design 9.158851113716295E-4 chemical 0.0
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