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Application

Discovery Studio 0.9130312014683044 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0692090395480226 Amorphous Cell 0.2842749529190207 Blends 0.002542372881355932 CASTEP 0.39331450094161957 CDOCKER 0.1553672316384181 CHARMm 0.2431261770244821 COMPASS 0.37175141242937854 COMPASS III 0.08248587570621468 COSMObase 0.0034839924670433146 COSMOconf 0.0040489642184557435 COSMOmic 1.8832391713747646E-4 COSMOperm 0.001224105461393597 COSMOplex 2.824858757062147E-4 COSMOquick 0.0014124293785310734 COSMOtherm 0.06308851224105462 Cantera 0.0 Catalyst 0.11544256120527308 Classical Simulations 1.0 Conformers 9.416195856873823E-4 Crystallization 0.07589453860640301 DFTB Plus 0.005838041431261771 DMol3 0.18060263653483993 DPD 0.0029190207156308853 Discover 0.0035781544256120526 Forcite 0.5467984934086629 GULP 0.025047080979284368 Kinetix 2.824858757062147E-4 LUDI 0.004143126177024482 LibDock 0.06591337099811675 LigandFit 0.005367231638418079 MCSS 6.591337099811676E-4 MODELER 0.1768361581920904 MesoDyn 0.0014124293785310734 Mesocite 0.004143126177024482 Mesoscale 0.007532956685499058 Modules 0.0 Morphology 0.017984934086629004 ONETEP 9.416195856873823E-4 Polymorph 0.0017890772128060263 QMERA 2.824858757062147E-4 QSAR 0.0010357815442561206 Quantum Mechanics 0.5629001883239171 Reflex 0.05555555555555555 Reflex Plus 8.47457627118644E-4 Semi-empirical 0.007815442561205274 Sorption 0.05621468926553672 Synthia 0.0016007532956685499 TURBOMOLE 5.649717514124294E-4 VAMP 0.0015065913370998117 Visualization 0.7864406779661017 X-Cell 0.001224105461393597 ZDOCK 0.027306967984934087

Year

2022 0.07719298245614035 2023 0.35982456140350877 2024 0.7442982456140351 2025 1.0 2026 0.3728947368421053 2027 0.0

Keywords

target 1.0 potential 0.27421182989798915 docking 0.20658242727005582 visualization 0.19193148902229126 analysis 0.18848914823055288 between 0.15629066789807314 novel 0.09835859115906133 energy 0.09260736325091307 binding 0.0650266571512531 cell 0.0638512237101717 promising 0.05516141219931993 activity 0.04659753998572688 stability 0.036312497376264644 interaction 0.03530498299819487 performance 0.03282817681877335 experimental 0.03140086478317451 synthesized 0.028966038369505898 effective 0.02036018639015994 mechanism 0.019646530372360523 development 0.017883380210738424 including 0.016288149112127955 protein 0.012803828554636664 synthesis 0.009655346123168632 design 6.716762520465136E-4 chemical 0.0
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