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Application

Discovery Studio 0.9911236635061529 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06439588688946016 Amorphous Cell 0.2800771208226221 Blends 0.002442159383033419 CASTEP 0.36362467866323905 CDOCKER 0.16593830334190232 CHARMm 0.26401028277634964 COMPASS 0.3507712082262211 COMPASS III 0.08868894601542417 COSMObase 0.0037275064267352186 COSMOconf 0.004627249357326478 COSMOmic 0.0 COSMOperm 7.712082262210797E-4 COSMOplex 1.2853470437017994E-4 COSMOquick 0.0012853470437017994 COSMOtherm 0.061568123393316194 Cantera 0.0 Catalyst 0.10989717223650386 Classical Simulations 1.0 Conformers 7.712082262210797E-4 Crystallization 0.07326478149100257 DFTB Plus 0.004498714652956298 DMol3 0.16298200514138816 DPD 0.002442159383033419 Discover 0.0034704370179948585 Forcite 0.5311053984575835 GULP 0.021593830334190232 Kinetix 2.570694087403599E-4 LUDI 0.004627249357326478 LibDock 0.06928020565552699 LigandFit 0.004884318766066838 MCSS 6.426735218508997E-4 MODELER 0.21388174807197943 MesoDyn 8.997429305912597E-4 Mesocite 0.0035989717223650387 Mesoscale 0.006426735218508998 Modules 0.0 Morphology 0.017352185089974295 ONETEP 0.0011568123393316196 Polymorph 0.0017994858611825194 QMERA 1.2853470437017994E-4 QSAR 7.712082262210797E-4 Quantum Mechanics 0.5173521850899743 Reflex 0.0532133676092545 Reflex Plus 7.712082262210797E-4 Semi-empirical 0.006298200514138818 Sorption 0.056298200514138814 Synthia 8.997429305912597E-4 TURBOMOLE 6.426735218508997E-4 VAMP 0.0014138817480719794 Visualization 0.775706940874036 X-Cell 0.0014138817480719794 ZDOCK 0.027892030848329048

Year

2022 0.025202812330989723 2023 0.22033531638723636 2024 0.5861546782044348 2025 1.0 2026 0.4594916170903191 2027 0.0

Keywords

target 1.0 potential 0.29155965444781695 docking 0.2225075881391548 analysis 0.2020196124212001 visualization 0.190170441279477 between 0.15141256128881625 novel 0.10057202895166939 energy 0.08428671491944899 binding 0.0739551716086855 promising 0.06712584636936726 cell 0.06315666588839598 activity 0.05241653046929722 stability 0.03986691571328508 performance 0.03432173710016344 interaction 0.028251225776325006 synthesized 0.026441746439411627 experimental 0.024048564090590707 including 0.021071678729862247 effective 0.021013308428671492 mechanism 0.020079383609619427 development 0.01826990427270605 protein 0.016693906140555687 synthesis 0.009105766985757647 design 0.002801774457156199 enhanced 0.0
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