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Application

Discovery Studio 1.0 Materials Studio 0.9748028198506317 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06522147147147148 Amorphous Cell 0.27852852852852855 Blends 0.00243993993993994 CASTEP 0.39667792792792794 CDOCKER 0.17417417417417416 CHARMm 0.2615427927927928 COMPASS 0.36524024024024027 COMPASS III 0.08051801801801801 COSMObase 0.0033783783783783786 COSMOconf 0.003941441441441441 COSMOmic 9.384384384384384E-5 COSMOperm 0.00121996996996997 COSMOplex 2.8153153153153153E-4 COSMOquick 0.001313813813813814 COSMOtherm 0.06540915915915915 Cantera 0.0 Catalyst 0.11580330330330331 Classical Simulations 1.0 Conformers 9.384384384384384E-4 Crystallization 0.0723536036036036 DFTB Plus 0.0063813813813813815 DMol3 0.18102477477477477 DPD 0.002627627627627628 Discover 0.004598348348348348 Forcite 0.5304992492492493 GULP 0.024962462462462462 Kinetix 1.8768768768768769E-4 LUDI 0.004692192192192192 LibDock 0.07150900900900901 LigandFit 0.006287537537537537 MCSS 0.00121996996996997 MODELER 0.20664414414414414 MesoDyn 0.0015015015015015015 Mesocite 0.0038475975975975976 Mesoscale 0.007132132132132132 Modules 0.0 Morphology 0.017361111111111112 ONETEP 7.507507507507507E-4 Polymorph 0.0020645645645645644 QMERA 1.8768768768768769E-4 QSAR 0.001313813813813814 Quantum Mechanics 0.5653153153153153 Reflex 0.05227102102102102 Reflex Plus 8.445945945945946E-4 Semi-empirical 0.008352102102102103 Sorption 0.054147897897897895 Synthia 0.0015953453453453454 TURBOMOLE 4.692192192192192E-4 VAMP 0.0015953453453453454 Visualization 0.8628941441441441 X-Cell 0.001313813813813814 ZDOCK 0.029654654654654656

Year

2020 0.021620090634441088 2021 0.1404833836858006 2022 0.16361404833836857 2023 0.3541351963746224 2024 0.78672583081571 2025 1.0 2026 0.4012462235649547 2027 0.0

Keywords

target 1.0 potential 0.269964720974984 docking 0.2187700449005773 visualization 0.20814624759461192 analysis 0.1854554201411161 between 0.1504169339320077 novel 0.10054522129570237 energy 0.08074085952533676 binding 0.07003688261706222 cell 0.058531109685695956 activity 0.052317190506735084 promising 0.05079377806286081 interaction 0.03439704939063502 stability 0.02794259140474663 synthesized 0.027501603592046182 experimental 0.027381334188582424 protein 0.01916292495189224 performance 0.017920141116100064 development 0.017118345093008337 mechanism 0.015354393842206543 effective 0.014873316228351507 including 0.01098460551635664 synthesis 0.010142719692110327 design 6.815266196279667E-4 chemical 0.0
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