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Application

Discovery Studio 0.9241550695825049 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07016107016107016 Amorphous Cell 0.2751160251160251 Antibody 1.365001365001365E-4 Blends 0.003549003549003549 CASTEP 0.4307944307944308 CDOCKER 0.17615342615342616 CHARMm 0.2512285012285012 COMPASS 0.3791291291291291 COMPASS III 0.06586131586131586 COSMObase 0.0026617526617526617 COSMOconf 0.003071253071253071 COSMOmic 2.73000273000273E-4 COSMOperm 0.001365001365001365 COSMOplex 2.73000273000273E-4 COSMOquick 0.001365001365001365 COSMOtherm 0.06681681681681682 Cantera 0.0 Catalyst 0.13322413322413323 Classical Simulations 1.0 Conformers 0.0017745017745017745 Crystallization 0.07923832923832924 DFTB Plus 0.006142506142506142 DMol3 0.2029074529074529 DPD 0.003549003549003549 Discover 0.005937755937755937 Forcite 0.5328282828282829 GULP 0.028255528255528257 Kinetix 2.0475020475020476E-4 LUDI 0.006006006006006006 LibDock 0.06688506688506689 LigandFit 0.01092001092001092 MCSS 0.0014332514332514332 MODELER 0.21061971061971063 MesoDyn 0.0015015015015015015 Mesocite 0.004914004914004914 Mesoscale 0.008667758667758667 Modules 0.0 Morphology 0.018495768495768495 ONETEP 0.0012967512967512968 Polymorph 0.0020475020475020475 QMERA 2.0475020475020476E-4 QSAR 0.0015697515697515698 Quantum Mechanics 0.6212121212121212 Reflex 0.05828555828555829 Reflex Plus 8.872508872508873E-4 Reflex QPA 0.0 Semi-empirical 0.0085995085995086 Sorption 0.05262080262080262 Synthia 0.0010237510237510238 TURBOMOLE 6.142506142506142E-4 VAMP 0.0021157521157521156 Visualization 0.7965465465465466 X-Cell 0.0012285012285012285 ZDOCK 0.030098280098280097

Year

2016 0.0 2017 0.03625218914185639 2018 0.08458844133099824 2019 0.09509632224168126 2020 0.10919439579684763 2021 0.13984238178633976 2022 0.35718038528896673 2023 0.5965849387040281 2024 0.8601576182136602 2025 1.0 2026 0.3731173380035026 2027 8.756567425569177E-4

Keywords

target 1.0 potential 0.23177128868683336 docking 0.18432709681179693 visualization 0.1801014163315265 analysis 0.1596141516582153 between 0.15302791863379378 novel 0.0923529754619106 energy 0.08232791280526898 binding 0.0562452643235997 cell 0.05574983971556799 activity 0.047385906627032695 promising 0.03488372093023256 interaction 0.03456315206621204 experimental 0.030978609313982632 synthesized 0.0252375123856152 mechanism 0.01801014163315265 stability 0.017077577665092963 performance 0.01034563152066212 protein 0.008946785568572594 development 0.008538788832546482 effective 0.00783936585650172 synthesis 0.0049833887043189366 chemical 0.001806842688115638 design 8.742787200559538E-4 including 0.0
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