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Application

Discovery Studio 0.9746835443037974 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.10857142857142857 Amorphous Cell 0.21714285714285714 Blends 0.0 CASTEP 0.49714285714285716 CDOCKER 0.14285714285714285 CHARMm 0.27714285714285714 COMPASS 0.31142857142857144 COMPASS III 0.09428571428571429 COSMObase 0.002857142857142857 COSMOconf 0.0 COSMOtherm 0.07714285714285714 Catalyst 0.09142857142857143 Classical Simulations 1.0 Crystallization 0.06857142857142857 DFTB Plus 0.002857142857142857 DMol3 0.16857142857142857 Discover 0.0 Forcite 0.48857142857142855 GULP 0.008571428571428572 LUDI 0.002857142857142857 LibDock 0.037142857142857144 LigandFit 0.0 MODELER 0.26285714285714284 Morphology 0.022857142857142857 ONETEP 0.0 QSAR 0.0 Quantum Mechanics 0.6628571428571428 Reflex 0.045714285714285714 Semi-empirical 0.005714285714285714 Sorption 0.05142857142857143 VAMP 0.0 Visualization 0.7371428571428571 ZDOCK 0.011428571428571429

Year

2024 0.30418943533697634 2025 1.0 2026 0.5537340619307832 2027 0.0

Keywords

strong 1.0 target 0.9276546091015169 potential 0.411901983663944 analysis 0.2742123687281214 docking 0.2637106184364061 between 0.19253208868144692 binding 0.15752625437572929 promising 0.14469078179696615 visualization 0.11435239206534423 novel 0.10851808634772463 stability 0.10385064177362893 energy 0.06884480746791131 activity 0.056009334889148193 including 0.052508751458576426 interaction 0.039673278879813305 effective 0.0338389731621937 performance 0.03150525087514586 synthesized 0.030338389731621937 stable 0.026837806301050177 therapeutic 0.019836639439906652 experimental 0.012835472578763127 inhibition 0.009334889148191364 cell 0.004667444574095682 compound 0.003500583430571762 enhanced 0.0
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