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Application

Discovery Studio 0.982064491509254 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06203531598513011 Amorphous Cell 0.2778810408921933 Blends 0.0018587360594795538 CASTEP 0.33224907063197023 CDOCKER 0.17007434944237917 CHARMm 0.27346654275092935 COMPASS 0.3403810408921933 COMPASS III 0.1029275092936803 COSMObase 0.004182156133828996 COSMOconf 0.005808550185873606 COSMOmic 0.0 COSMOperm 6.970260223048327E-4 COSMOplex 2.3234200743494423E-4 COSMOquick 0.0016263940520446097 COSMOtherm 0.06366171003717472 Catalyst 0.07690520446096655 Classical Simulations 1.0 Conformers 2.3234200743494423E-4 Crystallization 0.07434944237918216 DFTB Plus 0.004414498141263941 DMol3 0.15288104089219332 DPD 0.0027881040892193307 Discover 0.0037174721189591076 Forcite 0.5220724907063197 GULP 0.019516728624535316 Kinetix 0.0 LUDI 0.0034851301115241635 LibDock 0.07156133828996282 LigandFit 0.0037174721189591076 MCSS 0.0 MODELER 0.245817843866171 MesoDyn 6.970260223048327E-4 Mesocite 0.0025557620817843866 Mesoscale 0.0055762081784386614 Modules 0.0 Morphology 0.01742565055762082 ONETEP 6.970260223048327E-4 Polymorph 0.0018587360594795538 QMERA 0.0 QSAR 6.970260223048327E-4 Quantum Mechanics 0.4758364312267658 Reflex 0.05413568773234201 Reflex Plus 0.0011617100371747212 Semi-empirical 0.005808550185873606 Sorption 0.05552973977695167 Synthia 9.293680297397769E-4 TURBOMOLE 0.0 VAMP 9.293680297397769E-4 Visualization 0.6935408921933085 X-Cell 0.0011617100371747212 ZDOCK 0.028113382899628253

Year

2023 0.0 2024 0.3317591499409681 2025 1.0 2026 0.5629954461123292 2027 8.433125316242199E-4

Keywords

target 1.0 potential 0.28081413369149705 docking 0.19836759995867342 analysis 0.1936150428763302 visualization 0.14877569996900505 between 0.1367909908048352 novel 0.08947205289802665 promising 0.0797603058167166 energy 0.0728381031098254 binding 0.07015187519371836 cell 0.0580638495712367 activity 0.043909494782518856 stability 0.03709060853393946 performance 0.03378448186796157 including 0.02252298791197438 effective 0.0159107345800186 development 0.015394152288459551 synthesized 0.01208802562248166 interaction 0.01126149395598719 mechanism 0.01115817749767538 experimental 0.008678582498191962 strong 0.0076454179150738715 enhanced 0.007128835623514826 protein 0.002892860832730654 design 0.0
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