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Application

Discovery Studio 1.0 Materials Studio 0.9030230469919186 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.054075235109717866 Amorphous Cell 0.26802507836990597 Blends 0.001959247648902821 CASTEP 0.3232758620689655 CDOCKER 0.18808777429467086 CHARMm 0.2884012539184953 COMPASS 0.3248432601880878 COMPASS III 0.10697492163009405 COSMObase 0.0035266457680250786 COSMOconf 0.0066614420062695925 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 3.9184952978056425E-4 COSMOquick 7.836990595611285E-4 COSMOtherm 0.06935736677115988 Catalyst 0.09404388714733543 Classical Simulations 1.0 Conformers 3.9184952978056425E-4 Crystallization 0.07053291536050156 DFTB Plus 0.0066614420062695925 DMol3 0.14615987460815047 DPD 0.0023510971786833857 Discover 0.0011755485893416929 Forcite 0.5101880877742947 GULP 0.01920062695924765 Kinetix 3.9184952978056425E-4 LUDI 0.003134796238244514 LibDock 0.07758620689655173 LigandFit 0.004310344827586207 MODELER 0.26606583072100315 MesoDyn 0.0 Mesocite 0.001959247648902821 Mesoscale 0.004702194357366771 Modules 0.0 Morphology 0.016849529780564265 ONETEP 0.0011755485893416929 Polymorph 0.001959247648902821 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4627742946708464 Reflex 0.049764890282131664 Reflex Plus 7.836990595611285E-4 Semi-empirical 0.008228840125391849 Sorption 0.06191222570532915 Synthia 0.001567398119122257 TURBOMOLE 0.0 VAMP 7.836990595611285E-4 Visualization 0.7456896551724138 X-Cell 7.836990595611285E-4 ZDOCK 0.02860501567398119

Year

2023 8.878366380585972E-4 2024 0.515833086712045 2025 1.0 2026 0.5184965966262208 2027 0.0

Keywords

target 1.0 potential 0.288135593220339 docking 0.21748615539520053 analysis 0.1995301225037758 visualization 0.16345024332941768 between 0.13357945964087933 novel 0.09447893941936567 promising 0.0803826145326397 binding 0.0704816244336298 energy 0.06796442356100017 cell 0.05705655311293841 activity 0.05604967276388656 stability 0.0364155059573754 performance 0.031213290820607486 including 0.023997314985735863 synthesized 0.02382950159422722 development 0.020305420372545728 effective 0.017452592716898807 mechanism 0.016613525759355596 interaction 0.014599765061251888 protein 0.012753817754656822 experimental 0.01258600436314818 synthesis 0.010740057056553114 enhanced 0.006712535660345695 design 0.0
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