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Application

Discovery Studio 0.9844100853275165 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06799691701635695 Amorphous Cell 0.27841055065513404 Blends 0.0025691530358825042 CASTEP 0.4106362935685536 CDOCKER 0.17161942279695128 CHARMm 0.25665838828466214 COMPASS 0.37312665924466903 COMPASS III 0.07424852273700437 COSMObase 0.0029117067740001713 COSMOconf 0.003511175815706089 COSMOmic 1.712768690588336E-4 COSMOperm 0.0012845765179412521 COSMOplex 3.425537381176672E-4 COSMOquick 0.0015414918215295025 COSMOtherm 0.06508521024235676 Cantera 8.56384345294168E-5 Catalyst 0.1243470069367132 Classical Simulations 1.0 Conformers 0.0011132996488824184 Crystallization 0.0754474608204162 DFTB Plus 0.006337244155176843 DMol3 0.1879763637920699 DPD 0.002997345208529588 Discover 0.00453883703005909 Forcite 0.5344694698980903 GULP 0.026633553138648625 Kinetix 2.569153035882504E-4 LUDI 0.005395221375353258 LibDock 0.07073734692129828 LigandFit 0.006936713196882761 MCSS 0.0012845765179412521 MODELER 0.1818960349404813 MesoDyn 0.0016271302560589191 Mesocite 0.0036824526847649224 Mesoscale 0.007364905369529845 Modules 0.0 Morphology 0.017898432816648113 ONETEP 0.0012845765179412521 Polymorph 0.0017984071251177529 QMERA 1.712768690588336E-4 QSAR 0.0014558533870000856 Quantum Mechanics 0.5863663612229169 Reflex 0.055408067140532674 Reflex Plus 6.851074762353344E-4 Semi-empirical 0.008649481887471097 Sorption 0.05626445148582684 Synthia 0.0016271302560589191 TURBOMOLE 5.994690417059176E-4 VAMP 0.0019696839941765864 Visualization 0.8477348634066969 X-Cell 0.0011989380834118353 ZDOCK 0.02997345208529588

Year

2020 0.0 2021 0.11311100959342166 2022 0.21443581544084056 2023 0.46158063042485153 2024 0.9284604842393787 2025 1.0 2026 0.32023755139333027 2027 6.395614435815441E-4

Keywords

target 1.0 potential 0.2515668825097822 docking 0.2009418608677586 visualization 0.1931853596038644 analysis 0.16946570172097372 between 0.1463000796426469 novel 0.09519027667162991 energy 0.08095848194189549 binding 0.06527234322518093 cell 0.05585373454759514 activity 0.0477163336680633 promising 0.04498078188302919 interaction 0.037328162332490734 experimental 0.02808268984383116 synthesized 0.027355517850341078 stability 0.027043872710273902 mechanism 0.017833027459399565 performance 0.01762526403268811 effective 0.016517192423560374 protein 0.016067038332352228 development 0.01592852938121126 synthesis 0.012673569029398524 including 0.009522490390941515 chemical 0.0033242148273832195 design 0.0
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