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Application

Discovery Studio 1.0 Materials Studio 0.9734149996742034 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06791856791856792 Amorphous Cell 0.27737802737802736 Blends 0.002457002457002457 CASTEP 0.39285714285714285 CDOCKER 0.1740961740961741 CHARMm 0.26114426114426115 COMPASS 0.3642506142506142 COMPASS III 0.07871182871182872 COSMObase 0.0033345033345033347 COSMOconf 0.0037732537732537734 COSMOmic 2.6325026325026325E-4 COSMOperm 0.0013162513162513162 COSMOplex 3.51000351000351E-4 COSMOquick 0.001404001404001404 COSMOtherm 0.06282906282906282 Cantera 0.0 Catalyst 0.1290803790803791 Classical Simulations 1.0 Conformers 0.001053001053001053 Crystallization 0.07423657423657423 DFTB Plus 0.00544050544050544 DMol3 0.17892242892242893 DPD 0.0029835029835029833 Discover 0.0037732537732537734 Forcite 0.5328185328185329 GULP 0.02527202527202527 Kinetix 2.6325026325026325E-4 LUDI 0.004914004914004914 LibDock 0.0716040716040716 LigandFit 0.006493506493506494 MCSS 8.775008775008775E-4 MODELER 0.17953667953667954 MesoDyn 0.0014917514917514917 Mesocite 0.0040365040365040366 Mesoscale 0.007546507546507547 Modules 0.0 Morphology 0.0171990171990172 ONETEP 0.001053001053001053 Polymorph 0.001755001755001755 QMERA 2.6325026325026325E-4 QSAR 9.652509652509653E-4 Quantum Mechanics 0.5601965601965602 Reflex 0.05475605475605476 Reflex Plus 7.897507897507897E-4 Semi-empirical 0.007371007371007371 Sorption 0.05510705510705511 Synthia 0.0014917514917514917 TURBOMOLE 5.265005265005265E-4 VAMP 0.0014917514917514917 Visualization 0.8683748683748683 X-Cell 0.0012285012285012285 ZDOCK 0.030186030186030187

Year

2021 0.01367461430575035 2022 0.260343618513324 2023 0.37727910238429174 2024 0.8192496493688639 2025 1.0 2026 0.37263323983169705 2027 0.0

Keywords

target 1.0 potential 0.27342047930283225 docking 0.2225227255653219 visualization 0.21290661858613177 analysis 0.18619938396814664 between 0.15284351288408082 novel 0.10247163999699496 energy 0.08410337315002629 binding 0.07377357073097439 cell 0.061227556156562245 activity 0.054466230936819175 promising 0.05116069416272256 interaction 0.038915182931410115 stability 0.032679738562091505 synthesized 0.03080159266771843 experimental 0.028134625497708662 performance 0.021974306964164976 protein 0.021410863195853055 effective 0.020208849823454285 mechanism 0.019682968973029825 development 0.018368266846968673 synthesis 0.014799789647659831 including 0.014123657125685524 design 0.0013898279618360754 chemical 0.0
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