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Application

Discovery Studio 1.0 Materials Studio 0.9702073326442512 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06571097116340736 Amorphous Cell 0.27734504474643684 Antibody 8.286377195889956E-5 Blends 0.002651640702684786 CASTEP 0.403463705667882 CDOCKER 0.17649983427245608 CHARMm 0.26176665561816376 COMPASS 0.36725223732184287 COMPASS III 0.0760689426582698 COSMObase 0.003065959562479284 COSMOconf 0.003646005966191581 COSMOmic 8.286377195889956E-5 COSMOperm 0.0012429565793834936 COSMOplex 2.485913158766987E-4 COSMOquick 0.001325820351342393 COSMOtherm 0.06446801458402386 Cantera 8.286377195889956E-5 Catalyst 0.12288697381504807 Classical Simulations 1.0 Conformers 0.0010772290354656945 Crystallization 0.07474312230692741 DFTB Plus 0.006131919124958568 DMol3 0.18387470997679814 DPD 0.0029830957905203847 Discover 0.004557507457739476 Forcite 0.5295823665893271 GULP 0.025936360623135566 Kinetix 2.485913158766987E-4 LUDI 0.005634736493205171 LibDock 0.07225720914816043 LigandFit 0.007292011932383162 MCSS 0.0012429565793834936 MODELER 0.19572422936692077 MesoDyn 0.0016572754391779914 Mesocite 0.003977461054027179 Mesoscale 0.0075406032482598605 Modules 0.0 Morphology 0.018312893602916804 ONETEP 9.115014915478953E-4 Polymorph 0.0019058667550546902 QMERA 2.485913158766987E-4 QSAR 0.0014086841233012927 Quantum Mechanics 0.5755717600265164 Reflex 0.05419290686112032 Reflex Plus 7.457739476300962E-4 Semi-empirical 0.008286377195889956 Sorption 0.05469008949287372 Synthia 0.0014915478952601923 TURBOMOLE 6.629101756711965E-4 VAMP 0.0017401392111368909 Visualization 0.8810076234670202 X-Cell 0.0012429565793834936 ZDOCK 0.030162412993039442

Year

2020 0.05781208877971752 2021 0.1348363891569436 2022 0.18984121414159136 2023 0.46039126239143785 2024 0.830774629353452 2025 1.0 2026 0.37292744977629616 2027 0.0

Keywords

target 1.0 potential 0.26549728117874055 docking 0.21775127170671812 visualization 0.2118926504122084 analysis 0.18024907910892826 between 0.14895632345202597 novel 0.09847395193825645 energy 0.07981055955095598 binding 0.0695316611120856 cell 0.0562357481143659 activity 0.05227153131029644 promising 0.044904402736362044 interaction 0.0359936853183652 synthesized 0.027328538852832835 experimental 0.025714786879494824 stability 0.025083318716014734 protein 0.019575513067882827 mechanism 0.01617260129801789 development 0.014944746535695492 performance 0.014874583406419926 effective 0.013190668303806349 synthesis 0.01024381687423259 including 0.008700228030170145 chemical 0.001368181020873531 design 0.0
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