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Application

Discovery Studio 0.931209375615521 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06973915393972159 Amorphous Cell 0.28132180024327613 Blends 0.0032436815785917015 CASTEP 0.4278280848763346 CDOCKER 0.1673874847952426 CHARMm 0.24280308149749966 COMPASS 0.38620083795107446 COMPASS III 0.06967157724016759 COSMObase 0.0027030679821597515 COSMOconf 0.00304095147992972 COSMOmic 2.7030679821597514E-4 COSMOperm 0.0012839572915258818 COSMOplex 4.730368968779565E-4 COSMOquick 0.0016218407892958507 COSMOtherm 0.06615758886335991 Cantera 6.757669955399378E-5 Catalyst 0.11271793485606163 Classical Simulations 1.0 Conformers 0.0016218407892958507 Crystallization 0.07805108798486282 DFTB Plus 0.00608190295985944 DMol3 0.19975672388160562 DPD 0.0033788349776996893 Discover 0.005744019462089471 Forcite 0.5425733207190161 GULP 0.02858494391133937 Kinetix 2.0273009866198134E-4 LUDI 0.005676442762535478 LibDock 0.06690093255845385 LigandFit 0.007636167049601297 MCSS 0.0014866873901878631 MODELER 0.18117313150425735 MesoDyn 0.00195972428706582 Mesocite 0.004797945668333558 Mesoscale 0.008784970942019191 Modules 0.0 Morphology 0.018448438978240302 ONETEP 0.0012163805919718882 Polymorph 0.002094877686173807 QMERA 4.054601973239627E-4 QSAR 0.001554264089741857 Quantum Mechanics 0.6140018921475875 Reflex 0.05737261792134072 Reflex Plus 7.433436950939316E-4 Semi-empirical 0.008447087444249223 Sorption 0.054601973239626976 Synthia 0.0014191106906338694 TURBOMOLE 5.406135964319503E-4 VAMP 0.0018245708879578322 Visualization 0.8397756453574807 X-Cell 0.0011488038924178942 ZDOCK 0.029193134207325316

Year

2020 0.04108199492814878 2021 0.25198647506339816 2022 0.2945054945054945 2023 0.6494505494505495 2024 1.0 2025 0.9667793744716822 2026 0.35934065934065934 2027 0.0

Keywords

target 1.0 potential 0.24536744879811828 visualization 0.19858298433824795 docking 0.19617348402271814 analysis 0.16826343870116459 between 0.15334748436693246 novel 0.09313866100625323 energy 0.08596752911479548 binding 0.06020882336067925 cell 0.05845906717916356 activity 0.044403648671906375 promising 0.03800699902472606 interaction 0.03751936205610694 experimental 0.031036658826229132 synthesized 0.024783431816877977 stability 0.02260340772187482 mechanism 0.017497561815156906 performance 0.014829900751534623 effective 0.013366989845677241 protein 0.012420400436004819 development 0.01216223968791234 synthesis 0.007888245080603522 chemical 0.0037289885835580286 including 0.003413458780333888 design 0.0
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