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Application

Discovery Studio 0.9131009132157831 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06910152244221819 Amorphous Cell 0.2833477952196892 Blends 0.002682022560542715 CASTEP 0.4250216928295338 CDOCKER 0.16242013094580737 CHARMm 0.24264415871262918 COMPASS 0.38053167153111933 COMPASS III 0.07627987694249429 COSMObase 0.002997554626488917 COSMOconf 0.0034708527254082196 COSMOmic 2.3664904945965134E-4 COSMOperm 0.0013410112802713576 COSMOplex 3.155320659462018E-4 COSMOquick 0.0014987773132444585 COSMOtherm 0.06436854145302516 Cantera 7.888301648655044E-5 Catalyst 0.11982330204307012 Classical Simulations 1.0 Conformers 0.0011043622308117063 Crystallization 0.07769977123925219 DFTB Plus 0.005995109252977834 DMol3 0.1940522205569141 DPD 0.0031553206594620176 Discover 0.004890747022166127 Forcite 0.5447661118561173 GULP 0.026977991638400253 Kinetix 2.3664904945965134E-4 LUDI 0.004811864005679577 LibDock 0.06673503194762168 LigandFit 0.005995109252977834 MCSS 9.465961978386054E-4 MODELER 0.1692040703636507 MesoDyn 0.0015776603297310088 Mesocite 0.004417448923246825 Mesoscale 0.007967184665141595 Modules 0.0 Morphology 0.0178275617259604 ONETEP 0.0011832452472982566 Polymorph 0.0019720754121637612 QMERA 2.3664904945965134E-4 QSAR 0.001419894296757908 Quantum Mechanics 0.6066103967815729 Reflex 0.05750571901869528 Reflex Plus 7.09947148378954E-4 Semi-empirical 0.008124950698114695 Sorption 0.05553364360653151 Synthia 0.0014987773132444585 TURBOMOLE 5.521811154058532E-4 VAMP 0.0017354263627041098 Visualization 0.8221187978228287 X-Cell 0.001262128263784807 ZDOCK 0.027766821803265757

Year

2020 0.0 2021 0.04345233023770981 2022 0.2793729232342166 2023 0.39098577149186337 2024 1.0 2025 0.9752066115702479 2026 0.3630399591036892 2027 8.520064752492119E-4

Keywords

target 1.0 potential 0.2591633737566426 docking 0.20019757460144433 visualization 0.19508788663305626 analysis 0.17662488077394742 between 0.15472135168279058 novel 0.09551710042240087 energy 0.09020302493527728 binding 0.0608734159967298 cell 0.05968115547077259 promising 0.04455647908434392 activity 0.044420220738520234 interaction 0.036585365853658534 experimental 0.03178225916337376 stability 0.02980651314893037 synthesized 0.027081346232456737 performance 0.022891402098378526 effective 0.017032293227960214 mechanism 0.01665758277694509 development 0.01355770540945633 protein 0.01045782804196757 synthesis 0.009129309170186674 including 0.008345823681700504 chemical 0.0034745878185038835 design 0.0
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