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Application

Discovery Studio 1.0 Materials Studio 0.984 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06878218973251371 Amorphous Cell 0.27413191560059813 Blends 0.002824389433460708 CASTEP 0.4040538295397907 CDOCKER 0.17386609071274298 CHARMm 0.26000996843329455 COMPASS 0.3708257185579 COMPASS III 0.07625851470343911 COSMObase 0.003073600265824888 COSMOconf 0.003572021930553248 COSMOmic 2.492108323641801E-4 COSMOperm 0.0012460541618209006 COSMOplex 3.322811098189068E-4 COSMOquick 0.001661405549094534 COSMOtherm 0.06205349725868085 Cantera 0.0 Catalyst 0.12211330785844825 Classical Simulations 1.0 Conformers 9.968433294567204E-4 Crystallization 0.07675693636816747 DFTB Plus 0.005565708589466689 DMol3 0.18491443761422163 DPD 0.0029074597109154344 Discover 0.004236584150191062 Forcite 0.5321481973749792 GULP 0.025087223791327464 Kinetix 2.492108323641801E-4 LUDI 0.005233427479647782 LibDock 0.07127429805615551 LigandFit 0.007393254693470676 MCSS 0.0011629838843661739 MODELER 0.18890181093204853 MesoDyn 0.0013291244392756273 Mesocite 0.004153513872736335 Mesoscale 0.007310184416015949 Modules 0.0 Morphology 0.017777039375311512 ONETEP 0.0013291244392756273 Polymorph 0.0018275461040039873 QMERA 1.661405549094534E-4 QSAR 0.0013291244392756273 Quantum Mechanics 0.5766738660907127 Reflex 0.05673699950157834 Reflex Plus 7.476324970925403E-4 Semi-empirical 0.00755939524838013 Sorption 0.05540787506230271 Synthia 0.0013291244392756273 TURBOMOLE 4.984216647283602E-4 VAMP 0.001661405549094534 Visualization 0.8710749293902642 X-Cell 0.0012460541618209006 ZDOCK 0.030736002658248877

Year

2020 0.02015422362425517 2021 0.12951279355064843 2022 0.21074307746232038 2023 0.4262180161233789 2024 0.8615492464072906 2025 1.0 2026 0.3725026288117771 2027 0.0

Keywords

target 1.0 potential 0.2651627480053661 docking 0.21633834639553767 visualization 0.21104285815152157 analysis 0.1812822142201511 between 0.15215702887806257 novel 0.09990821153710372 energy 0.08268022311657135 binding 0.07014756760573325 cell 0.05800324789945633 activity 0.052107604321118405 promising 0.047659394196144886 interaction 0.03788039257219516 stability 0.029442914636729507 synthesized 0.027501235613923605 experimental 0.026971686789521995 protein 0.019099060933418063 mechanism 0.018287086069335594 effective 0.01765162748005366 performance 0.01754571771517334 development 0.016451316811410013 synthesis 0.01239144249099767 including 0.009214149544588011 design 5.648520793617172E-4 chemical 0.0
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