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Application

Discovery Studio 1.0 Materials Studio 0.9964862965565706 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06794392523364486 Amorphous Cell 0.27579439252336446 Blends 0.0027102803738317757 CASTEP 0.4014018691588785 CDOCKER 0.17233644859813085 CHARMm 0.26093457943925236 COMPASS 0.36336448598130844 COMPASS III 0.08037383177570094 COSMObase 0.0033644859813084112 COSMOconf 0.003925233644859813 COSMOmic 2.8037383177570094E-4 COSMOperm 0.001308411214953271 COSMOplex 2.8037383177570094E-4 COSMOquick 0.001588785046728972 COSMOtherm 0.061588785046728975 Cantera 0.0 Catalyst 0.12 Classical Simulations 1.0 Conformers 0.00102803738317757 Crystallization 0.07457943925233645 DFTB Plus 0.005420560747663551 DMol3 0.18168224299065422 DPD 0.002616822429906542 Discover 0.00411214953271028 Forcite 0.534392523364486 GULP 0.024485981308411214 Kinetix 2.8037383177570094E-4 LUDI 0.004953271028037384 LibDock 0.07065420560747664 LigandFit 0.006261682242990654 MCSS 8.411214953271028E-4 MODELER 0.19457943925233645 MesoDyn 0.0012149532710280374 Mesocite 0.003644859813084112 Mesoscale 0.006822429906542056 Modules 0.0 Morphology 0.017009345794392523 ONETEP 0.001308411214953271 Polymorph 0.0019626168224299067 QMERA 1.8691588785046728E-4 QSAR 0.0011214953271028037 Quantum Mechanics 0.5713084112149532 Reflex 0.05495327102803738 Reflex Plus 8.411214953271028E-4 Semi-empirical 0.007196261682242991 Sorption 0.05663551401869159 Synthia 0.0012149532710280374 TURBOMOLE 5.607476635514019E-4 VAMP 0.0014018691588785046 Visualization 0.8488785046728972 X-Cell 0.001308411214953271 ZDOCK 0.028785046728971964

Year

2021 0.0785479719534925 2022 0.15194816721398774 2023 0.32661755569361856 2024 0.7625809887281442 2025 1.0 2026 0.37729652968847077 2027 0.0

Keywords

target 1.0 potential 0.2744324585412977 docking 0.21868459185316375 visualization 0.20612622766060215 analysis 0.18934149090323618 between 0.1543632265335695 novel 0.101191434551602 energy 0.08529222347448076 binding 0.0722105941072291 cell 0.05920946707454516 promising 0.05401706649492835 activity 0.05329254548381903 interaction 0.03803735308323941 stability 0.032844952503622606 synthesized 0.02849782643696667 experimental 0.02745129608758654 performance 0.023627435195620675 effective 0.019723071969087104 mechanism 0.019401062630816295 protein 0.017026243761069072 development 0.01698599259378522 including 0.01308162936725165 synthesis 0.01211560135243922 design 8.050233456770246E-4 chemical 0.0
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