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Application

Discovery Studio 1.0 Materials Studio 0.974360852684785 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06672519754170325 Amorphous Cell 0.27548531850551167 Blends 0.002438786459857575 CASTEP 0.3842551946151595 CDOCKER 0.1723734269827334 CHARMm 0.2641693493317725 COMPASS 0.35752609501512045 COMPASS III 0.08223587942639743 COSMObase 0.003511852502194908 COSMOconf 0.004097161252560726 COSMOmic 1.95102916788606E-4 COSMOperm 0.0013657204175202419 COSMOplex 1.95102916788606E-4 COSMOquick 0.0013657204175202419 COSMOtherm 0.0619451760803824 Cantera 0.0 Catalyst 0.12593893278704515 Classical Simulations 1.0 Conformers 8.77963125548727E-4 Crystallization 0.07277338796215004 DFTB Plus 0.005657984586869573 DMol3 0.1732513901082821 DPD 0.002536337918251878 Discover 0.003219198127011999 Forcite 0.5324358599161058 GULP 0.02409521022339284 Kinetix 2.92654375182909E-4 LUDI 0.00487757291971515 LibDock 0.07218807921178422 LigandFit 0.006340844795629695 MCSS 8.77963125548727E-4 MODELER 0.18534777094917568 MesoDyn 0.001268168959125939 Mesocite 0.003414301043800605 Mesoscale 0.006731050629206907 Modules 0.0 Morphology 0.016973953760608722 ONETEP 9.755145839430299E-4 Polymorph 0.001755926251097454 QMERA 1.95102916788606E-4 QSAR 9.755145839430299E-4 Quantum Mechanics 0.5468734757584626 Reflex 0.05336064774168374 Reflex Plus 8.77963125548727E-4 Semi-empirical 0.0072188079211784216 Sorption 0.05511657399278119 Synthia 0.0014632718759145448 TURBOMOLE 5.85308750365818E-4 VAMP 0.001170617500731636 Visualization 0.8497707540727734 X-Cell 0.001268168959125939 ZDOCK 0.02965564335186811

Year

2021 0.0 2022 0.1320239563149551 2023 0.36841641712171924 2024 0.6701602959309494 2025 1.0 2026 0.3751981680465034 2027 7.926721860137397E-4

Keywords

target 1.0 potential 0.2814974802015839 docking 0.22559606996146192 visualization 0.21107017320967264 analysis 0.1944691483504849 between 0.15207724558505908 novel 0.10417990090204549 energy 0.08469910642442723 binding 0.07644094354804556 cell 0.062126794562317365 promising 0.05856943209249142 activity 0.05526616694193876 interaction 0.03832634565705332 stability 0.03629356710286707 synthesized 0.030915173844915936 experimental 0.027146063609028926 performance 0.026553169864057934 effective 0.022106466776775507 protein 0.021428873925380086 mechanism 0.020624232414348027 development 0.019861940456528185 including 0.01744801592343201 synthesis 0.015034091390335833 design 0.002540973192732817 chemical 0.0
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