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Application

Discovery Studio 0.8544005035141089 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06805555555555555 Amorphous Cell 0.28888888888888886 Blends 0.0025 CASTEP 0.38208333333333333 CDOCKER 0.1490277777777778 CHARMm 0.23708333333333334 COMPASS 0.36569444444444443 COMPASS III 0.09305555555555556 COSMObase 0.0038888888888888888 COSMOconf 0.005555555555555556 COSMOmic 0.0 COSMOperm 8.333333333333334E-4 COSMOplex 2.777777777777778E-4 COSMOquick 0.00125 COSMOtherm 0.0675 Cantera 0.0 Catalyst 0.09902777777777778 Classical Simulations 1.0 Conformers 5.555555555555556E-4 Crystallization 0.07597222222222222 DFTB Plus 0.005833333333333334 DMol3 0.17180555555555554 DPD 0.0025 Discover 0.0038888888888888888 Forcite 0.5495833333333333 GULP 0.021666666666666667 Kinetix 2.777777777777778E-4 LUDI 0.004027777777777778 LibDock 0.0625 LigandFit 0.0043055555555555555 MCSS 5.555555555555556E-4 MODELER 0.19569444444444445 MesoDyn 8.333333333333334E-4 Mesocite 0.0031944444444444446 Mesoscale 0.0059722222222222225 Modules 0.0 Morphology 0.018194444444444444 ONETEP 0.0011111111111111111 Polymorph 0.0020833333333333333 QMERA 1.388888888888889E-4 QSAR 9.722222222222222E-4 Quantum Mechanics 0.5436111111111112 Reflex 0.05486111111111111 Reflex Plus 6.944444444444445E-4 Semi-empirical 0.007638888888888889 Sorption 0.058194444444444444 Synthia 0.0015277777777777779 TURBOMOLE 5.555555555555556E-4 VAMP 0.001388888888888889 Visualization 0.7125 X-Cell 0.001388888888888889 ZDOCK 0.025972222222222223

Year

2022 0.0 2023 0.20829980457523853 2024 0.5062650879411427 2025 1.0 2026 0.4872973905046557 2027 4.5982296815725947E-4

Keywords

target 1.0 potential 0.28183824483967285 docking 0.19693625860054526 analysis 0.1947942360119434 visualization 0.1690250551733091 between 0.15734129559911722 energy 0.09470336232636635 novel 0.09347007659353498 cell 0.06718161755160328 promising 0.06705179800077891 binding 0.06250811372192652 activity 0.04271063222121251 performance 0.04271063222121251 stability 0.03972478255225237 experimental 0.029014669609243152 synthesized 0.024016616902505516 interaction 0.021355316110606256 effective 0.019278203297416592 including 0.019278203297416592 development 0.01733091003505128 mechanism 0.01622744385304427 enhanced 0.005906789562508114 design 0.003570037647669739 synthesis 0.0022718421394261976 protein 0.0
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