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Application

Discovery Studio 1.0 Materials Studio 0.9864618588909139 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06820548420687261 Amorphous Cell 0.27611940298507465 Blends 0.0024297119055883376 CASTEP 0.395001735508504 CDOCKER 0.1723359944463728 CHARMm 0.2594585213467546 COMPASS 0.36662617146824017 COMPASS III 0.07792433182922597 COSMObase 0.003297466157584172 COSMOconf 0.003644567858382506 COSMOmic 2.6032627559875043E-4 COSMOperm 0.0013016313779937521 COSMOplex 2.6032627559875043E-4 COSMOquick 0.0014751822283929192 COSMOtherm 0.06273863241929885 Cantera 0.0 Catalyst 0.12521693856299895 Classical Simulations 1.0 Conformers 0.0010413051023950017 Crystallization 0.0755813953488372 DFTB Plus 0.005466851787573759 DMol3 0.1801457827143353 DPD 0.0028635890315862546 Discover 0.00399166955918084 Forcite 0.5338424158278375 GULP 0.02516487330787921 Kinetix 2.6032627559875043E-4 LUDI 0.004859423811176675 LibDock 0.07106907323845887 LigandFit 0.0064213814647691774 MCSS 8.677542519958348E-4 MODELER 0.17988545643873655 MesoDyn 0.0013884068031933356 Mesocite 0.004078444984380423 Mesoscale 0.007375911141964595 Modules 0.0 Morphology 0.01744186046511628 ONETEP 0.0010413051023950017 Polymorph 0.0019090593543908366 QMERA 1.7355085039916696E-4 QSAR 0.0011280805275945853 Quantum Mechanics 0.5629989586948976 Reflex 0.055709822978132595 Reflex Plus 7.809788267962514E-4 Semi-empirical 0.007375911141964595 Sorption 0.05588337382853176 Synthia 0.0013884068031933356 TURBOMOLE 5.206525511975009E-4 VAMP 0.0015619576535925027 Visualization 0.861246095105866 X-Cell 0.0012148559527941688 ZDOCK 0.030111072544255466

Year

2021 0.03401420180590865 2022 0.24318400981853247 2023 0.376873849390725 2024 0.8391338651705094 2025 1.0 2026 0.37266590689927237 2027 0.0

Keywords

target 1.0 potential 0.2720946675101403 docking 0.22074200870762475 visualization 0.2112529304506382 analysis 0.186395266624493 between 0.1529044021880698 novel 0.10222156067428274 energy 0.08532728016968705 binding 0.07237747925427009 cell 0.061176645703866335 activity 0.05351095895508503 promising 0.05049678115580694 interaction 0.039482007963383324 stability 0.03282104714769471 synthesized 0.030402262493953038 experimental 0.028541658914151752 performance 0.02232724295761545 protein 0.020094518661853904 effective 0.019908458303873777 mechanism 0.019759610017489673 development 0.017899006437688388 synthesis 0.014177799278085811 including 0.01391731477691363 design 0.0014140587206489786 chemical 0.0
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