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Application

Discovery Studio 1.0 Materials Studio 0.9776510832383124 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06693548387096775 Amorphous Cell 0.27681451612903224 Blends 0.0025201612903225806 CASTEP 0.3824596774193548 CDOCKER 0.1721774193548387 CHARMm 0.26401209677419357 COMPASS 0.35604838709677417 COMPASS III 0.08377016129032258 COSMObase 0.0036290322580645163 COSMOconf 0.004133064516129032 COSMOmic 2.0161290322580645E-4 COSMOperm 0.001310483870967742 COSMOplex 2.0161290322580645E-4 COSMOquick 0.001310483870967742 COSMOtherm 0.061088709677419355 Cantera 0.0 Catalyst 0.12298387096774194 Classical Simulations 1.0 Conformers 9.072580645161291E-4 Crystallization 0.0719758064516129 DFTB Plus 0.005443548387096774 DMol3 0.1722782258064516 DPD 0.0025201612903225806 Discover 0.0033266129032258063 Forcite 0.5338709677419354 GULP 0.023588709677419356 Kinetix 3.024193548387097E-4 LUDI 0.004737903225806452 LibDock 0.0717741935483871 LigandFit 0.00594758064516129 MCSS 8.064516129032258E-4 MODELER 0.19143145161290323 MesoDyn 0.0012096774193548388 Mesocite 0.0034274193548387098 Mesoscale 0.0066532258064516125 Modules 0.0 Morphology 0.01683467741935484 ONETEP 0.0010080645161290322 Polymorph 0.0018145161290322581 QMERA 2.0161290322580645E-4 QSAR 8.064516129032258E-4 Quantum Mechanics 0.5442540322580646 Reflex 0.05262096774193548 Reflex Plus 9.072580645161291E-4 Semi-empirical 0.007056451612903226 Sorption 0.05584677419354839 Synthia 0.0012096774193548388 TURBOMOLE 6.048387096774194E-4 VAMP 0.0012096774193548388 Visualization 0.8405241935483871 X-Cell 0.001310483870967742 ZDOCK 0.028729838709677418

Year

2021 0.0010665718602790863 2022 0.1294107190471958 2023 0.3256599413385477 2024 0.6393209492489557 2025 1.0 2026 0.3778330815038663 2027 0.0

Keywords

target 1.0 potential 0.28358405911850093 docking 0.226093076449371 visualization 0.20889416732647137 analysis 0.19600598222926013 between 0.15386645552916337 novel 0.10556875164951174 energy 0.08542271487639659 binding 0.07702120172428961 cell 0.06334125098970704 promising 0.0605260842790534 activity 0.05577549045482537 interaction 0.038224685493094046 stability 0.0374329198557227 synthesized 0.03127474267616785 performance 0.028503562945368172 experimental 0.02713996656989531 effective 0.023181138383038622 protein 0.021201724289610275 mechanism 0.021069763350048384 development 0.020190023752969122 including 0.018034661740124924 synthesis 0.013679950734582563 design 0.0029471276502155363 chemical 0.0
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