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Application

Discovery Studio 1.0 Materials Studio 0.7561837455830389 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05502717391304348 Amorphous Cell 0.18546195652173914 Blends 0.001358695652173913 CASTEP 0.5095108695652174 CDOCKER 0.23369565217391305 CHARMm 0.4123641304347826 COMPASS 0.2547554347826087 COMPASS III 0.07201086956521739 COSMObase 0.009510869565217392 COSMOconf 0.004076086956521739 COSMOperm 0.0 COSMOquick 0.001358695652173913 COSMOtherm 0.08491847826086957 Catalyst 0.21671195652173914 Classical Simulations 1.0 Crystallization 0.07744565217391304 DFTB Plus 0.004076086956521739 DMol3 0.22894021739130435 DPD 6.793478260869565E-4 Discover 0.002717391304347826 Forcite 0.4171195652173913 GULP 0.019021739130434784 Kinetix 0.0 LUDI 0.006114130434782609 LibDock 0.08627717391304347 LigandFit 0.008152173913043478 MCSS 0.0 MODELER 0.27241847826086957 Mesocite 6.793478260869565E-4 Mesoscale 0.0020380434782608695 Morphology 0.006793478260869565 ONETEP 0.0 Polymorph 0.001358695652173913 QMERA 0.0 QSAR 0.001358695652173913 Quantum Mechanics 0.720108695652174 Reflex 0.06793478260869565 Reflex Plus 6.793478260869565E-4 Semi-empirical 0.006114130434782609 Sorption 0.050271739130434784 Synthia 0.0 VAMP 6.793478260869565E-4 Visualization 0.9911684782608695 X-Cell 0.001358695652173913 ZDOCK 0.02717391304347826

Year

2022 0.013339466421343146 2023 0.24425022999080037 2024 0.6600735970561178 2025 1.0 2026 0.3169273229070837 2027 0.0

Keywords

promising 1.0 target 0.9384920634920635 potential 0.41517857142857145 docking 0.2542162698412698 analysis 0.1956845238095238 visualization 0.15848214285714285 novel 0.15823412698412698 binding 0.09077380952380952 activity 0.07043650793650794 stability 0.06721230158730158 between 0.06324404761904762 energy 0.05654761904761905 synthesized 0.045882936507936505 development 0.041666666666666664 therapeutic 0.03844246031746032 including 0.027529761904761904 compound 0.026785714285714284 effective 0.023313492063492064 synthesis 0.022817460317460316 drug 0.014136904761904762 strategy 0.011656746031746032 vitro 0.009176587301587302 strong 0.006944444444444444 silico 0.001488095238095238 design 0.0
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