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Application

Discovery Studio 1.0 Materials Studio 0.6234232149056822 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07466291004226203 Amorphous Cell 0.17991547595089555 Antibody 0.0 Blends 0.002012477359629704 CASTEP 0.41960152948279333 CDOCKER 0.18957536727711813 CHARMm 0.3435298852887905 COMPASS 0.2757093982692695 COMPASS III 0.03139464681022339 COSMObase 0.0012074864157778226 COSMOconf 0.0016099818877037633 COSMOmic 4.024954719259408E-4 COSMOperm 8.049909438518816E-4 COSMOplex 0.0 COSMOquick 8.049909438518816E-4 COSMOtherm 0.05333065003018716 Catalyst 0.1652243912255987 Classical Simulations 0.8619440531294023 Conformers 0.0016099818877037633 Crystallization 0.0448782451197424 DFTB Plus 0.00503119339907426 DMol3 0.18353793519822903 DPD 0.001408734151740793 Discover 0.010464882270074461 Forcite 0.3421211511370497 GULP 0.02877842624270477 Kinetix 0.0 LUDI 0.008452404910444758 LibDock 0.08875025155966995 LigandFit 0.020527269068222984 MCSS 0.001408734151740793 MODELER 0.32904004829945666 MesoDyn 0.001408734151740793 Mesocite 0.0022137250955926746 Mesoscale 0.00482994566311129 Modules 0.0 Morphology 0.012276111893741195 ONETEP 0.0 Polymorph 0.002012477359629704 QMERA 4.024954719259408E-4 QSAR 0.002817468303481586 Quantum Mechanics 0.5902596095793923 Reflex 0.0285771785067418 Reflex Plus 0.0018112296236667338 Reflex QPA 0.0 Semi-empirical 0.008049909438518816 Sorption 0.030388408130408533 Synthia 4.024954719259408E-4 TURBOMOLE 0.0 VAMP 0.0022137250955926746 Visualization 1.0 X-Cell 0.002012477359629704 ZDOCK 0.03481585832159388

Year

2010 0.0030358227079538553 2011 0.022161505768063146 2012 0.031876138433515486 2013 0.03764420157862781 2014 0.03642987249544627 2015 0.04978749241044323 2016 0.0840922890103218 2017 0.12143290831815422 2018 0.13327261687917424 2019 0.16029143897996356 2020 0.18973891924711597 2021 0.385853066180935 2022 0.4435336976320583 2023 0.5989678202792957 2024 1.0 2025 0.9359441408621737 2026 0.26806314511232543 2027 0.0

Keywords

analysis 1.0 target 0.9476336719426727 docking 0.3230963067958107 potential 0.29994487754941335 visualization 0.22623828647925034 between 0.16851720607921883 binding 0.12804157807701394 novel 0.09433813686117017 interaction 0.07937632884479093 protein 0.0791400897708481 activity 0.07016300496102056 energy 0.06071344200330735 experimental 0.04772029293645169 including 0.030632333254586974 stability 0.0255925663438066 silico 0.024332624616111506 mechanism 0.02212772659264509 promising 0.021261516654854713 cell 0.01858414048350264 drug 0.015198047090322072 compound 0.013386880856760375 synthesized 0.005669737774627924 well 0.003543586109142452 chemical 3.1498543192377354E-4 effective 0.0
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