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Application

Discovery Studio 0.9650948563461634 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06899119837508463 Amorphous Cell 0.2665538253215978 Antibody 1.3540961408259986E-4 Blends 0.0031144211238997967 CASTEP 0.43087339201083275 CDOCKER 0.17995937711577523 CHARMm 0.2651320243737305 COMPASS 0.3730534867975626 COMPASS III 0.06391333784698713 COSMObase 0.002708192281651997 COSMOconf 0.003182125930941097 COSMOmic 3.3852403520649965E-4 COSMOperm 0.0014218009478672985 COSMOplex 3.3852403520649965E-4 COSMOquick 0.0017603249830737983 COSMOtherm 0.06648612051455653 Cantera 0.0 Catalyst 0.14224779959377115 Classical Simulations 1.0 Conformers 0.0013540961408259986 Crystallization 0.07867298578199051 DFTB Plus 0.0058903182125930945 DMol3 0.2031144211238998 DPD 0.003994583615436696 Discover 0.0067027758970886935 Forcite 0.5182802979011509 GULP 0.02972241029113067 Kinetix 2.0311442112389978E-4 LUDI 0.0071090047393364926 LibDock 0.07000677048070413 LigandFit 0.012863913337846988 MCSS 0.0014218009478672985 MODELER 0.223019634394042 MesoDyn 0.0017603249830737983 Mesocite 0.0050778605280974946 Mesoscale 0.009478672985781991 Modules 0.0 Morphology 0.01814488828706838 ONETEP 0.0017603249830737983 Polymorph 0.0020988490182802977 QMERA 3.3852403520649965E-4 QSAR 0.0016926201760324984 Quantum Mechanics 0.6210561949898443 Reflex 0.05809072444143534 Reflex Plus 0.0012186865267433988 Reflex QPA 0.0 Semi-empirical 0.008463100880162491 Sorption 0.05335138794854435 Synthia 0.0012186865267433988 TURBOMOLE 8.124576844955991E-4 VAMP 0.0020988490182802977 Visualization 0.8035883547731889 X-Cell 0.0013540961408259986 ZDOCK 0.02999322951929587

Year

2016 0.030895167678901506 2017 0.07226476542557873 2018 0.0846756447495819 2019 0.09638236070768419 2020 0.1091453217146378 2021 0.1826423730305431 2022 0.38244872810492037 2023 0.5986268814364932 2024 0.797641052724232 2025 1.0 2026 0.3741748085555849 2027 0.0

Keywords

target 1.0 potential 0.23212810211699006 docking 0.1883066928797333 visualization 0.1832350343334188 analysis 0.1600706613100835 between 0.15568282189360913 novel 0.0969313616548423 energy 0.08274211471065904 binding 0.06313929965524119 cell 0.055759751545716156 activity 0.05199874633159529 interaction 0.03869276576345557 promising 0.03701171040259851 experimental 0.03262387098612417 synthesized 0.026953870701199534 mechanism 0.021340855343761574 stability 0.01755135766589737 protein 0.01504402085648346 performance 0.012023819699689433 development 0.010855628686212497 synthesis 0.009402513035302162 effective 0.008832663760435365 chemical 0.005385075647491238 design 0.004188392170270963 including 0.0
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