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Application

Discovery Studio 1.0 Materials Studio 0.9804176072234763 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0674841894184791 Amorphous Cell 0.2763381150701836 Blends 0.0026222427888323305 CASTEP 0.41516273330248343 CDOCKER 0.17746413697362332 CHARMm 0.2607589079130032 COMPASS 0.3705846058923338 COMPASS III 0.07450254511800093 COSMObase 0.002930741940459664 COSMOconf 0.0033934906679006635 COSMOmic 2.3137436372049977E-4 COSMOperm 0.0013111213944161653 COSMOplex 3.0849915162733303E-4 COSMOquick 0.001465370970229832 COSMOtherm 0.06316520129569644 Cantera 7.712478790683326E-5 Catalyst 0.12532778034860403 Classical Simulations 1.0 Conformers 0.0011568718186024988 Crystallization 0.07558229214869659 DFTB Plus 0.006015733456732994 DMol3 0.18941847909918247 DPD 0.003007866728366497 Discover 0.004627487274409995 Forcite 0.5310812895264538 GULP 0.026453802252043808 Kinetix 2.3137436372049977E-4 LUDI 0.005861483880919328 LibDock 0.07195742711707542 LigandFit 0.007558229214869659 MCSS 0.0013111213944161653 MODELER 0.19026685176615765 MesoDyn 0.001542495758136665 Mesocite 0.0041647385469689956 Mesoscale 0.007635354002776492 Modules 0.0 Morphology 0.017430202066944317 ONETEP 0.0011568718186024988 Polymorph 0.0019281196976708313 QMERA 2.3137436372049977E-4 QSAR 0.001465370970229832 Quantum Mechanics 0.5920869967607589 Reflex 0.05583834644454728 Reflex Plus 6.941230911614993E-4 Semi-empirical 0.008098102730217492 Sorption 0.054295850686410616 Synthia 0.001465370970229832 TURBOMOLE 5.398735153478328E-4 VAMP 0.0016967453339503317 Visualization 0.8843128181397502 X-Cell 0.0011568718186024988 ZDOCK 0.030387166435292302

Year

2020 0.0 2021 0.18388059701492537 2022 0.2936460554371002 2023 0.3887420042643923 2024 1.0 2025 0.9757782515991471 2026 0.3629850746268657 2027 4.2643923240938164E-4

Keywords

target 1.0 potential 0.2628630638215199 docking 0.21610594825632226 visualization 0.21173461127481139 analysis 0.17932195706375675 between 0.15111873846452742 novel 0.09963410290451057 energy 0.08169543114334747 binding 0.06926140595149435 cell 0.05682738075964123 activity 0.05190557912119936 promising 0.04377813036298287 interaction 0.039471553929346245 synthesized 0.028656542434348994 experimental 0.028559401612537644 stability 0.02622802188906518 protein 0.01881293915746527 mechanism 0.01703202409092381 effective 0.01635203833824434 development 0.015413010394067934 performance 0.015283489298319464 synthesis 0.013049250396658356 including 0.007900786840656673 chemical 0.002849464106466341 design 0.0
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