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Application

Discovery Studio 0.8711181188729691 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06885583309944802 Amorphous Cell 0.2856207315932267 Blends 0.002713069510711947 CASTEP 0.41472541865469176 CDOCKER 0.15576761156328936 CHARMm 0.237814575732061 COMPASS 0.3761811207783703 COMPASS III 0.08204696416877164 COSMObase 0.0033679483581251753 COSMOconf 0.004022827205538404 COSMOmic 1.871082421180653E-4 COSMOperm 0.0014968659369445224 COSMOplex 2.80662363177098E-4 COSMOquick 0.001590420058003555 COSMOtherm 0.06445878940967349 Cantera 0.0 Catalyst 0.11189072878660306 Classical Simulations 1.0 Conformers 8.419870895312938E-4 Crystallization 0.07736925811582 DFTB Plus 0.006174571989896155 DMol3 0.186266255028534 DPD 0.0030872859949480774 Discover 0.004022827205538404 Forcite 0.5497240153428758 GULP 0.02544672092805688 Kinetix 1.871082421180653E-4 LUDI 0.003929273084479371 LibDock 0.06408457292543737 LigandFit 0.005145476658246796 MCSS 3.742164842361306E-4 MODELER 0.17747216764898494 MesoDyn 0.0012162035737674245 Mesocite 0.004022827205538404 Mesoscale 0.0074843296847226124 Modules 0.0 Morphology 0.018149499485452334 ONETEP 0.0012162035737674245 Polymorph 0.002058190663298718 QMERA 1.871082421180653E-4 QSAR 0.0014968659369445224 Quantum Mechanics 0.5892038544297876 Reflex 0.05669379736177379 Reflex Plus 8.419870895312938E-4 Semi-empirical 0.008045654411076807 Sorption 0.056319580877537655 Synthia 0.0013097576948264572 TURBOMOLE 4.677706052951633E-4 VAMP 0.0014968659369445224 Visualization 0.7671437926840677 X-Cell 0.0013097576948264572 ZDOCK 0.026850032743942372

Year

2021 0.0023763421932758316 2022 0.13351522619257172 2023 0.28709734201725046 2024 0.7871853546910755 2025 1.0 2026 0.37414187643020597 2027 0.0

Keywords

target 1.0 potential 0.26974863479094585 docking 0.1953812163908458 analysis 0.18445954395764724 visualization 0.1820417691441911 between 0.15548793196881905 novel 0.09591896285797658 energy 0.0946683896786027 cell 0.06498811955479594 binding 0.06061111342698737 promising 0.055900621118012424 activity 0.04489557713952228 stability 0.036891908791529454 performance 0.03305681770811622 experimental 0.032514902663720875 interaction 0.03134770102963858 synthesized 0.027095752219767393 effective 0.019842427779398892 mechanism 0.019175455417066157 development 0.015423735878944517 including 0.013381133019300512 synthesis 0.007961982575347033 protein 0.0059193797157030305 chemical 0.0011672016340822876 design 0.0
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