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Application

Discovery Studio 1.0 Materials Studio 0.49144634525660963 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07803468208092486 Amorphous Cell 0.18208092485549132 Blends 0.0 CASTEP 0.30346820809248554 CDOCKER 0.2514450867052023 CHARMm 0.4046242774566474 COMPASS 0.23410404624277456 COMPASS III 0.07225433526011561 COSMObase 0.0 COSMOconf 0.005780346820809248 COSMOmic 0.0 COSMOperm 0.002890173410404624 COSMOtherm 0.05491329479768786 Catalyst 0.11560693641618497 Classical Simulations 0.9104046242774566 Crystallization 0.046242774566473986 DMol3 0.10404624277456648 Discover 0.0 Forcite 0.3583815028901734 GULP 0.011560693641618497 LUDI 0.0 LibDock 0.09826589595375723 LigandFit 0.0 MODELER 0.3815028901734104 Mesocite 0.005780346820809248 Mesoscale 0.005780346820809248 Morphology 0.008670520231213872 Polymorph 0.0 Quantum Mechanics 0.40173410404624277 Reflex 0.031791907514450865 Sorption 0.04335260115606936 Visualization 1.0 X-Cell 0.0 ZDOCK 0.02023121387283237

Year

2025 1.0 2026 0.5399698340874811 2027 0.0

Keywords

analysis 1.0 target 0.9229871645274212 potential 0.4632438739789965 docking 0.39789964994165694 visualization 0.21586931155192532 binding 0.17852975495915985 between 0.1353558926487748 promising 0.12602100350058343 therapeutic 0.10385064177362893 novel 0.09801633605600933 stability 0.09684947491248541 strong 0.09568261376896149 including 0.08751458576429405 activity 0.08284714119019837 protein 0.060676779463243874 silico 0.047841306884480746 interaction 0.039673278879813305 development 0.029171528588098017 inhibition 0.022170361726954493 mechanism 0.019836639439906652 compound 0.012835472578763127 effective 0.010501750291715286 stable 0.004667444574095682 experimental 0.003500583430571762 energy 0.0
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