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Application

Discovery Studio 1.0 Materials Studio 0.9768307009528782 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06803257157867088 Amorphous Cell 0.2766833026880308 Blends 0.0024516242010331844 CASTEP 0.3923474301724893 CDOCKER 0.17310218019437879 CHARMm 0.26127309342439364 COMPASS 0.36432886787496715 COMPASS III 0.0784519744330619 COSMObase 0.0033272042728307505 COSMOconf 0.0036774363015497765 COSMOmic 2.626740215392698E-4 COSMOperm 0.001313370107696349 COSMOplex 2.626740215392698E-4 COSMOquick 0.0014009281148761054 COSMOtherm 0.06260397513352596 Cantera 0.0 Catalyst 0.126258646353209 Classical Simulations 1.0 Conformers 0.0010506960861570791 Crystallization 0.07486209613869188 DFTB Plus 0.005516154452324665 DMol3 0.17940635671132124 DPD 0.0028894142369319674 Discover 0.00385255231590929 Forcite 0.5328780316959986 GULP 0.024954032046230628 Kinetix 2.626740215392698E-4 LUDI 0.004903248402066369 LibDock 0.0716224498730409 LigandFit 0.006479292531301988 MCSS 8.755800717975659E-4 MODELER 0.18124507486209615 MesoDyn 0.0014009281148761054 Mesocite 0.0040276683302688035 Mesoscale 0.007354872603099553 Modules 0.0 Morphology 0.01742404342877156 ONETEP 0.0010506960861570791 Polymorph 0.0018387181507748883 QMERA 1.7511601435951318E-4 QSAR 0.0011382540933368357 Quantum Mechanics 0.5599334559145434 Reflex 0.055073986516066896 Reflex Plus 7.880220646178094E-4 Semi-empirical 0.007354872603099553 Sorption 0.05542421854478592 Synthia 0.0014009281148761054 TURBOMOLE 5.253480430785396E-4 VAMP 0.001488486122055862 Visualization 0.8653357849575344 X-Cell 0.0012258121005165922 ZDOCK 0.030119954469836268

Year

2021 0.03007189198667368 2022 0.2427669647553919 2023 0.3767315448009819 2024 0.82140978432404 2025 1.0 2026 0.37269857969489745 2027 0.0

Keywords

target 1.0 potential 0.2735286394838516 docking 0.22303912374807758 visualization 0.21279867962039087 analysis 0.18721632469334934 between 0.15300648936569264 novel 0.10311714617952661 energy 0.08466184027908023 binding 0.07352113732698151 cell 0.061667729472223265 activity 0.05450316966127762 promising 0.05131475299148505 interaction 0.03957387748977831 stability 0.03319704415019318 synthesized 0.030983907873513634 experimental 0.028358152968978582 performance 0.022243895119846955 protein 0.021156082373682435 effective 0.02055590982407442 mechanism 0.01995573727446641 development 0.01815521962564237 synthesis 0.014854270602798305 including 0.0146292058966953 design 0.001763006864473536 chemical 0.0
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