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Application

Discovery Studio 0.8791619902731014 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06892734956731737 Amorphous Cell 0.28486617025558464 Blends 0.00251559669953713 CASTEP 0.40148923324612595 CDOCKER 0.15325015093580197 CHARMm 0.23988730126786073 COMPASS 0.36969209096397665 COMPASS III 0.08522841618031797 COSMObase 0.0037230831153149528 COSMOconf 0.004226202455222379 COSMOmic 2.012477359629704E-4 COSMOperm 0.001408734151740793 COSMOplex 3.0187160394445564E-4 COSMOquick 0.0016099818877037633 COSMOtherm 0.06500301871603945 Cantera 0.0 Catalyst 0.10464882270074462 Classical Simulations 1.0 Conformers 0.001006238679814852 Crystallization 0.0754679009861139 DFTB Plus 0.005634936606963172 DMol3 0.18112296236667338 DPD 0.002817468303481586 Discover 0.003924330851277923 Forcite 0.5473938418192795 GULP 0.025357214731334274 Kinetix 3.0187160394445564E-4 LUDI 0.003823706983296438 LibDock 0.06439927550815053 LigandFit 0.004628697927148319 MCSS 8.049909438518816E-4 MODELER 0.18333668746226606 MesoDyn 0.0016099818877037633 Mesocite 0.003823706983296438 Mesoscale 0.00734554236264842 Modules 0.0 Morphology 0.01740792916079694 ONETEP 0.0011068625477963373 Polymorph 0.002012477359629704 QMERA 2.012477359629704E-4 QSAR 9.056148118333669E-4 Quantum Mechanics 0.5706379553230027 Reflex 0.055343127389816865 Reflex Plus 9.056148118333669E-4 Semi-empirical 0.00734554236264842 Sorption 0.05795934795733548 Synthia 0.0015093580197222782 TURBOMOLE 6.037432078889113E-4 VAMP 0.0013081102837593076 Visualization 0.7612195612799356 X-Cell 0.0013081102837593076 ZDOCK 0.02626282954316764

Year

2021 0.0 2022 0.09602413915512957 2023 0.25230741924032657 2024 0.6793574724884629 2025 1.0 2026 0.37797302094426694 2027 7.099751508697196E-4

Keywords

target 1.0 potential 0.2758589511754069 docking 0.2003616636528029 analysis 0.1895117540687161 visualization 0.18485533453887884 between 0.16008137432188066 novel 0.1002260397830018 energy 0.0969258589511754 cell 0.06613924050632912 binding 0.06243218806509946 promising 0.059584086799276674 activity 0.045298372513562384 stability 0.03847197106690778 performance 0.03743218806509946 interaction 0.034990958408679926 experimental 0.034448462929475586 synthesized 0.028209764918625677 effective 0.021383363471971065 mechanism 0.020207956600361662 development 0.019891500904159132 including 0.018670886075949366 protein 0.010171790235081375 synthesis 0.00867992766726944 design 0.0036618444846292946 chemical 0.0
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