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Application

Discovery Studio 1.0 Materials Studio 0.9583124418021631 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06413766132186155 Amorphous Cell 0.27708251857645677 Antibody 9.777082518576456E-5 Blends 0.0024442706296441143 CASTEP 0.3970473210793899 CDOCKER 0.17833398513883458 CHARMm 0.26359014470082126 COMPASS 0.36605396949550256 COMPASS III 0.08036761830269848 COSMObase 0.003324208056315995 COSMOconf 0.004106374657802112 COSMOmic 9.777082518576456E-5 COSMOperm 0.0011732499022291747 COSMOplex 2.933124755572937E-4 COSMOquick 0.001368791552600704 COSMOtherm 0.06609307782557684 Cantera 0.0 Catalyst 0.1134141572154869 Classical Simulations 1.0 Conformers 8.799374266718811E-4 Crystallization 0.07323034806413767 DFTB Plus 0.006257332811888932 DMol3 0.18136488071959328 DPD 0.002933124755572937 Discover 0.004790770434102464 Forcite 0.5280602268283144 GULP 0.025322643723113023 Kinetix 1.9554165037152912E-4 LUDI 0.004986312084473993 LibDock 0.07313257723895189 LigandFit 0.007235041063746578 MCSS 0.0012710207274149394 MODELER 0.2177356276886977 MesoDyn 0.0016621040281579976 Mesocite 0.003813062182244818 Mesoscale 0.0073328118889323425 Modules 0.0 Morphology 0.017500977708251857 ONETEP 6.84395776300352E-4 Polymorph 0.0019554165037152915 QMERA 2.933124755572937E-4 QSAR 0.001368791552600704 Quantum Mechanics 0.5661908486507626 Reflex 0.05328509972624169 Reflex Plus 8.799374266718811E-4 Semi-empirical 0.008310520140789989 Sorption 0.05387172467735628 Synthia 0.0016621040281579976 TURBOMOLE 4.888541259288229E-4 VAMP 0.001564333202972233 Visualization 0.8696714900273759 X-Cell 0.0012710207274149394 ZDOCK 0.030993351583887368

Year

2020 0.06814891416752844 2021 0.15894519131334023 2022 0.1795243019648397 2023 0.3447776628748707 2024 0.8445708376421923 2025 1.0 2026 0.4394002068252327 2027 0.0

Keywords

target 1.0 potential 0.2691397000789266 docking 0.21974826569185393 visualization 0.2089477838242014 analysis 0.18510364308561458 between 0.15137290740663814 novel 0.10023677979479084 energy 0.0796743239313754 binding 0.07228014788352095 cell 0.057948739251443525 activity 0.05516553815477921 promising 0.0511361276118473 interaction 0.034810783865741705 synthesized 0.02741660781788726 stability 0.026710422465002284 experimental 0.02641964026087318 protein 0.019897810825406058 development 0.017405391932870853 mechanism 0.017197690358492917 performance 0.016699206579985876 effective 0.014788352095708885 including 0.011132804386657251 synthesis 0.009678893366011715 design 0.0021185560586549244 chemical 0.0
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