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Application

Discovery Studio 1.0 Materials Studio 0.9734435336359325 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06762219772142594 Amorphous Cell 0.273888276368982 Blends 0.0026644615950018376 CASTEP 0.40086365306872473 CDOCKER 0.1751194413818449 CHARMm 0.26442484380742376 COMPASS 0.3630099228224917 COMPASS III 0.07947445791988239 COSMObase 0.0033076074972436605 COSMOconf 0.003950753399485483 COSMOmic 2.756339581036384E-4 COSMOperm 0.0013781697905181918 COSMOplex 2.756339581036384E-4 COSMOquick 0.0016538037486218302 COSMOtherm 0.061925762587284085 Cantera 0.0 Catalyst 0.12302462330025726 Classical Simulations 1.0 Conformers 0.0010106578463800074 Crystallization 0.07515619257625873 DFTB Plus 0.005420801176038222 DMol3 0.18081587651598677 DPD 0.0026644615950018376 Discover 0.00404263138552003 Forcite 0.5315141492098493 GULP 0.02443954428518927 Kinetix 2.756339581036384E-4 LUDI 0.005145167217934583 LibDock 0.07184858507901506 LigandFit 0.006982726938625505 MCSS 0.0010106578463800074 MODELER 0.19615950018375597 MesoDyn 0.0011944138184490996 Mesocite 0.003583241455347299 Mesoscale 0.006798970966556413 Modules 0.0 Morphology 0.017089305402425578 ONETEP 0.0012862918044836457 Polymorph 0.0019294377067254685 QMERA 1.8375597206909226E-4 QSAR 0.0011944138184490996 Quantum Mechanics 0.5700110253583242 Reflex 0.05549430356486586 Reflex Plus 8.269018743109151E-4 Semi-empirical 0.007166482910694598 Sorption 0.05613744946710768 Synthia 0.0013781697905181918 TURBOMOLE 5.512679162072767E-4 VAMP 0.0013781697905181918 Visualization 0.8665931642778391 X-Cell 0.0012862918044836457 ZDOCK 0.030044101433296583

Year

2021 0.10060166342240312 2022 0.15218545390196425 2023 0.3509113431251106 2024 0.7767651743054327 2025 1.0 2026 0.3761281189170058 2027 0.0

Keywords

target 1.0 potential 0.2744690039652939 docking 0.2210356876447725 visualization 0.2107494798005575 analysis 0.18884221271249657 between 0.15268344391661104 novel 0.10203761140120136 energy 0.08272152644183581 binding 0.07337756664441915 cell 0.05845863923677908 activity 0.05417926269090338 promising 0.0536296179969377 interaction 0.038278826901181735 stability 0.031683090573593496 synthesized 0.027953358721683485 experimental 0.02685406933375211 performance 0.021318362058811983 effective 0.019551646971065133 mechanism 0.019002002277099448 protein 0.018844960935966392 development 0.016881944171803227 synthesis 0.01264182796121079 including 0.012327745278944683 design 9.029877115150564E-4 chemical 0.0
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