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Application

Discovery Studio 1.0 Materials Studio 0.9829293647754008 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06749925661611657 Amorphous Cell 0.2772078501338091 Antibody 1.486767766874814E-4 Blends 0.0026761819803746653 CASTEP 0.41153731787094855 CDOCKER 0.17744573297650906 CHARMm 0.2590692833779364 COMPASS 0.37340172465060956 COMPASS III 0.07255426702349094 COSMObase 0.002824858757062147 COSMOconf 0.0032708890871245913 COSMOmic 2.2301516503122213E-4 COSMOperm 0.001263752601843592 COSMOplex 2.973535533749628E-4 COSMOquick 0.0014124293785310734 COSMOtherm 0.06415402914064823 Cantera 7.43383883437407E-5 Catalyst 0.12184061849539102 Classical Simulations 1.0 Conformers 0.001263752601843592 Crystallization 0.07664287838239667 DFTB Plus 0.006021409455842997 DMol3 0.1889681831697889 DPD 0.0031222123104371097 Discover 0.005129348795718109 Forcite 0.531816830211121 GULP 0.026761819803746655 Kinetix 2.2301516503122213E-4 LUDI 0.005872732679155516 LibDock 0.0715878679750223 LigandFit 0.008102884329467737 MCSS 0.0014124293785310734 MODELER 0.1895628902765388 MesoDyn 0.002007136485280999 Mesocite 0.00423728813559322 Mesoscale 0.008177222717811478 Modules 0.0 Morphology 0.017989889979185252 ONETEP 8.920606601248885E-4 Polymorph 0.002007136485280999 QMERA 3.7169194171870356E-4 QSAR 0.0014867677668748143 Quantum Mechanics 0.5875706214689266 Reflex 0.0564228367528992 Reflex Plus 6.690454950936663E-4 Semi-empirical 0.008325899494498959 Sorption 0.0547873922093369 Synthia 0.0013380909901873326 TURBOMOLE 5.947071067499256E-4 VAMP 0.001784121320249777 Visualization 0.8832143919119834 X-Cell 0.0011894142134998512 ZDOCK 0.030255724055902468

Year

2020 0.07257923305900893 2021 0.1698476624058834 2022 0.2993346174050079 2023 0.49737348975661005 2024 0.9877429521975136 2025 1.0 2026 0.3721765014883558 2027 0.0

Keywords

target 1.0 potential 0.25789227166276346 docking 0.21342701014832163 visualization 0.211615925058548 analysis 0.1766744730679157 between 0.14988290398126464 novel 0.09864168618266979 energy 0.0809992193598751 binding 0.06854020296643247 cell 0.05686182669789227 activity 0.051147540983606556 promising 0.04115534738485558 interaction 0.03875097580015613 experimental 0.027884465261514443 synthesized 0.0273224043715847 stability 0.023762685402029665 protein 0.018391881342701016 mechanism 0.017548790007806403 effective 0.014176424668227947 development 0.013645589383294302 performance 0.013239656518345043 synthesis 0.01111631537861046 including 0.0072443403590944574 chemical 0.0020921155347384856 design 0.0
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