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Application

Discovery Studio 0.9782572669119353 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06902057387892888 Amorphous Cell 0.25491537794808633 Antibody 4.105652114410839E-4 Blends 0.0035582318324893936 CASTEP 0.4569134619770996 CDOCKER 0.19209890059760049 CHARMm 0.2832443775375211 COMPASS 0.3708772410017791 COMPASS III 0.0498608640116783 COSMObase 0.001961589343551845 COSMOconf 0.0025090096254732903 COSMOmic 3.193284977875097E-4 COSMOperm 0.001322932347976826 COSMOplex 5.018019250946581E-4 COSMOquick 0.0016422608457643355 COSMOtherm 0.0678801149582592 Cantera 4.56183568267871E-5 Catalyst 0.17275671730304273 Classical Simulations 1.0 Conformers 0.0017334975594179099 Crystallization 0.07768806167601842 DFTB Plus 0.006021623101135897 DMol3 0.22070161032799598 DPD 0.004926782537293006 Discover 0.00926052643583778 Forcite 0.49313443729756856 GULP 0.03389443912230281 Kinetix 1.368550704803613E-4 LUDI 0.010400985356507459 LibDock 0.06988732265863784 LigandFit 0.023037270197527486 MCSS 0.002463391268646503 MODELER 0.2563295470097167 MesoDyn 0.0025546279823000775 Mesocite 0.006112859814789471 Mesoscale 0.011267734136216413 Modules 0.0 Morphology 0.01906847315359701 ONETEP 0.002189681127685781 Polymorph 0.002326536198166142 QMERA 5.474202819214452E-4 QSAR 0.0020072077003786323 Quantum Mechanics 0.6634277633319647 Reflex 0.056338670681082066 Reflex Plus 0.0014597874184571872 Reflex QPA 0.0 Semi-empirical 0.009625473290452078 Sorption 0.049450298800237213 Synthia 0.0012316956343232516 TURBOMOLE 7.298937092285936E-4 VAMP 0.0029651931937411617 Visualization 0.7913872542311026 X-Cell 0.0011404589206696774 ZDOCK 0.032525888417499205

Year

2012 0.02576231100599713 2013 0.042148830137680546 2014 0.046034293436945685 2015 0.05828194948897711 2016 0.09105498775234394 2017 0.14097474448855477 2018 0.16428752428414561 2019 0.18599543880395303 2020 0.24554438719486443 2021 0.5066306275867895 2022 0.7351127629022721 2023 0.8455950671509418 2024 1.0 2025 0.9661288960216234 2026 0.35906748880817635 2027 0.0

Keywords

target 1.0 potential 0.2036362277407179 visualization 0.17276753181232132 docking 0.1709363379860605 between 0.15682867126333688 analysis 0.1416185511145991 novel 0.09510996505783209 energy 0.0789842479959639 binding 0.0620924192312723 activity 0.05426313134144291 cell 0.05069417194536316 interaction 0.04037969243417979 experimental 0.03733393127417456 synthesized 0.02586094138311191 promising 0.023207578900162566 mechanism 0.020105760786292205 protein 0.018181138703589513 chemical 0.01208961638357905 synthesis 0.009268083039034326 well 0.008875684361978437 design 0.00799745875142478 development 0.007922716146271278 stability 0.006222321879029094 performance 7.474260515350262E-5 effective 0.0
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