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Application

Discovery Studio 1.0 Materials Studio 0.9736588056819749 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06693674615597091 Amorphous Cell 0.27778289291962066 Blends 0.0024859589356412853 CASTEP 0.3839425467268207 CDOCKER 0.17235981953779578 CHARMm 0.26213055888039777 COMPASS 0.3632262222631434 COMPASS III 0.08019519381272443 COSMObase 0.00340668446736028 COSMOconf 0.003959119786391676 COSMOmic 9.207255317189946E-5 COSMOperm 0.001196943191234693 COSMOplex 2.762176595156984E-4 COSMOquick 0.0012890157444065925 COSMOtherm 0.062148973391032133 Cantera 0.0 Catalyst 0.12880950188748733 Classical Simulations 1.0 Conformers 8.286529785470951E-4 Crystallization 0.07411840530337906 DFTB Plus 0.005524353190313968 DMol3 0.17576650400515606 DPD 0.002854249148328883 Discover 0.003682902126875978 Forcite 0.5327317926526103 GULP 0.024215081484209557 Kinetix 2.762176595156984E-4 LUDI 0.004695700211766872 LibDock 0.07144830126139398 LigandFit 0.006168861062517263 MCSS 9.207255317189945E-4 MODELER 0.17981769634471964 MesoDyn 0.0012890157444065925 Mesocite 0.004143264892735476 Mesoscale 0.007365804253751956 Modules 0.0 Morphology 0.017677930209004697 ONETEP 0.001012798084890894 Polymorph 0.0017493785102660896 QMERA 2.762176595156984E-4 QSAR 0.001012798084890894 Quantum Mechanics 0.5489365620108646 Reflex 0.05413866126507688 Reflex Plus 8.286529785470951E-4 Semi-empirical 0.0075499493600957555 Sorption 0.05496731424362398 Synthia 0.0015652334039222909 TURBOMOLE 5.524353190313968E-4 VAMP 0.0015652334039222909 Visualization 0.8562747444986649 X-Cell 0.0012890157444065925 ZDOCK 0.03038394254672682

Year

2021 0.0 2022 0.20105217010083296 2023 0.37439719421306444 2024 0.7416922402455064 2025 1.0 2026 0.37334502411223147 2027 6.137658921525647E-4

Keywords

target 1.0 potential 0.2775742613681612 docking 0.2240981126065143 visualization 0.21147567094051126 analysis 0.18901807756629768 between 0.15210639483953173 novel 0.10257227044676276 energy 0.08385760930158477 binding 0.07394282073743728 cell 0.06287329776220435 activity 0.053874333041331525 promising 0.05359560404555228 interaction 0.03798678028191447 stability 0.03392530062913116 synthesized 0.03137692123914948 experimental 0.027594170582145416 performance 0.023174325077645934 protein 0.02205940909452895 effective 0.02050649040375886 development 0.01978975870032651 mechanism 0.019391574420641874 including 0.015847734331448593 synthesis 0.014852273632237 design 0.001871466114517799 chemical 0.0
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